2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide

C16H25N3O3 — CID 87007188

IUPAC2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide
SMILESCC(C)Oc1ccc(CNC(=O)N2CCOC(C)(C)C2)cn1
InChIInChI=1S/C16H25N3O3/c1-12(2)22-14-6-5-13(9-17-14)10-18-15(20)19-7-8-21-16(3,4)11-19/h5-6,9,12H,7-8,10-11H2,1-4H3,(H,18,20)
InChIKeyFQXXIUOSOMFUNT-UHFFFAOYSA-N
MW307.39 g/mol
LogP2.19
Rot. Bonds4

About 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide

2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide (PubChem CID 87007188) has the molecular formula C16H25N3O3 and a molecular weight of 307.39 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide
PubChem CID87007188
Molecular FormulaC16H25N3O3
Molecular Weight307.39 g/mol
Exact Mass307.19
IUPAC Name2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide
SMILESCC(C)Oc1ccc(CNC(=O)N2CCOC(C)(C)C2)cn1
InChIInChI=1S/C16H25N3O3/c1-12(2)22-14-6-5-13(9-17-14)10-18-15(20)19-7-8-21-16(3,4)11-19/h5-6,9,12H,7-8,10-11H2,1-4H3,(H,18,20)
InChIKeyFQXXIUOSOMFUNT-UHFFFAOYSA-N
XLogP2.19
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[(2,2-dimethylmorpholine-4-carbonyl)amino]methyl]benzoic acid
CID 61202032
N-benzyl-2,2-dimethylmorpholine-4-carboxamide
CID 38286944
4-N-methyl-1-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]piperidine-1,4-dicarboxamide
CID 71893034
N-[(3-butoxyphenyl)methyl]-2,2-dimethylmorpholine-4-carboxamide
CID 87004150
(2S)-2-methylsulfonyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]propanamide
CID 94173164
2,2-dimethyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]morpholine-4-carboxamide
CID 86984527
3,5-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]adamantane-1-carboxamide
CID 112829756
N-ethyl-2,2-dimethylmorpholine-4-carboxamide
CID 115583911
5-oxo-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]pyrrolidine-2-carboxamide
CID 51082730
1-[(2R)-1-imidazol-1-ylpropan-2-yl]-3-[(6-propan-2-yloxy-3-pyridinyl)methyl]urea
CID 94178624
N-[(5-chloro-2-methoxyphenyl)methyl]-2,2-dimethylmorpholine-4-carboxamide
CID 78892218
1-[(6-propan-2-yloxy-3-pyridinyl)methyl]-3-[(2R)-1-pyrazol-1-ylpropan-2-yl]urea
CID 94206278

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide?
The IUPAC name of 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide (CID 87007188) is 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide.
What is the SMILES notation for 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide?
The canonical SMILES for 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide is CC(C)Oc1ccc(CNC(=O)N2CCOC(C)(C)C2)cn1.
What is the InChIKey of 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide?
The InChIKey is FQXXIUOSOMFUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3/c1-12(2)22-14-6-5-13(9-17-14)10-18-15(20)19-7-8-21-16(3,4)11-19/h5-6,9,12H,7-8,10-11H2,1-4H3,(H,18,20).
What are the key properties of 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide?
2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide has a molecular weight of 307.39 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]morpholine-4-carboxamide is sourced from PubChem (CID 87007188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).