N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine

C126H201N19O11 — CID 159100578

About N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine

N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine (PubChem CID 159100578) has the molecular formula C126H201N19O11 and a molecular weight of 2158.12 g/mol. Its IUPAC name is N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine.

Molecular Properties

• Compound Name: N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine
• PubChem CID: 159100578
• Molecular Formula: C126H201N19O11
• Molecular Weight: 2158.12 g/mol
• Exact Mass: 2156.58
• IUPAC Name: N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine
• SMILES: CC(C)c1ccc(C(C)(C)N2CCOCC2)cn1.CC(C)c1ccc(C2CCOC2)c(CN2CCOCC2)n1.CC(C)c1ccc(N2CCOCC(N(C)C)C2)cn1.CC(C)c1ccc(N2CCOC[C@@H](N(C)C)C2)cn1.CC(C)c1ccc(N2CCOC[C@H](N(C)C)C2)cn1.CC(C)c1ccc([C@@H]2CCOC2)c(CN2CCOCC2)n1.CC(C)c1ccc([C@H]2CCOC2)c(CN2CCOCC2)n1.CC1CN(C(C)c2ccc(C(C)C)nc2)CCO1
• InChI: InChI=1S/3C17H26N2O2.3C15H25N3O.2C15H24N2O/c3*1-13(2)16-4-3-15(14-5-8-21-12-14)17(18-16)11-19-6-9-20-10-7-19;3*1-12(2)15-6-5-13(9-16-15)18-7-8-19-11-14(10-18)17(3)4;1-12(2)14-6-5-13(11-16-14)15(3,4)17-7-9-18-10-8-17;1-11(2)15-6-5-14(9-16-15)13(4)17-7-8-18-12(3)10-17/h3*3-4,13-14H,5-12H2,1-2H3;3*5-6,9,12,14H,7-8,10-11H2,1-4H3;5-6,11-12H,7-10H2,1-4H3;5-6,9,11-13H,7-8,10H2,1-4H3/t2*14-;;2*14-;;;/m10.10.../s1
• InChIKey: KDFLHCWBTWGHTB-MAMUVCDLSA-N
• XLogP: 19.30
• TPSA: 240.29 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 27
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2158.12
LogP ≤ 5	19.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine?

The IUPAC name of N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine (CID 159100578) is N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine.

What is the SMILES notation for N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine?

The canonical SMILES for N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine is CC(C)c1ccc(C(C)(C)N2CCOCC2)cn1.CC(C)c1ccc(C2CCOC2)c(CN2CCOCC2)n1.CC(C)c1ccc(N2CCOCC(N(C)C)C2)cn1.CC(C)c1ccc(N2CCOC[C@@H](N(C)C)C2)cn1.CC(C)c1ccc(N2CCOC[C@H](N(C)C)C2)cn1.CC(C)c1ccc([C@@H]2CCOC2)c(CN2CCOCC2)n1.CC(C)c1ccc([C@H]2CCOC2)c(CN2CCOCC2)n1.CC1CN(C(C)c2ccc(C(C)C)nc2)CCO1.

What is the InChIKey of N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine?

The InChIKey is KDFLHCWBTWGHTB-MAMUVCDLSA-N. The full InChI is InChI=1S/3C17H26N2O2.3C15H25N3O.2C15H24N2O/c3*1-13(2)16-4-3-15(14-5-8-21-12-14)17(18-16)11-19-6-9-20-10-7-19;3*1-12(2)15-6-5-13(9-16-15)18-7-8-19-11-14(10-18)17(3)4;1-12(2)14-6-5-13(11-16-14)15(3,4)17-7-9-18-10-8-17;1-11(2)15-6-5-14(9-16-15)13(4)17-7-8-18-12(3)10-17/h3*3-4,13-14H,5-12H2,1-2H3;3*5-6,9,12,14H,7-8,10-11H2,1-4H3;5-6,11-12H,7-10H2,1-4H3;5-6,9,11-13H,7-8,10H2,1-4H3/t2*14-;;2*14-;;;/m10.10.../s1.

What are the key properties of N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine?

N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine has a molecular weight of 2158.12 g/mol, XLogP of 19.30, 27 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6R)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;(6S)-N,N-dimethyl-4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepan-6-amine;2-methyl-4-[1-(6-propan-2-yl-3-pyridinyl)ethyl]morpholine;4-[[3-[(3R)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-[(3S)-oxolan-3-yl]-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[[3-(oxolan-3-yl)-6-propan-2-yl-2-pyridinyl]methyl]morpholine;4-[2-(6-propan-2-yl-3-pyridinyl)propan-2-yl]morpholine is sourced from PubChem (CID 159100578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).