N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine

C22H44N4O — CID 135257228

IUPACN,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine
SMILESCC(CC(C)N1CCC(C)(N2CCOCC2)CC1)N1CCC(N(C)C)CC1
InChIInChI=1S/C22H44N4O/c1-19(24-10-6-21(7-11-24)23(4)5)18-20(2)25-12-8-22(3,9-13-25)26-14-16-27-17-15-26/h19-21H,6-18H2,1-5H3
InChIKeyHDVQJMHWKOPOSF-UHFFFAOYSA-N
MW380.62 g/mol
LogP2.37
Rot. Bonds6

About N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine

N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine (PubChem CID 135257228) has the molecular formula C22H44N4O and a molecular weight of 380.62 g/mol. Its IUPAC name is N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine
PubChem CID135257228
Molecular FormulaC22H44N4O
Molecular Weight380.62 g/mol
Exact Mass380.35
IUPAC NameN,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine
SMILESCC(CC(C)N1CCC(C)(N2CCOCC2)CC1)N1CCC(N(C)C)CC1
InChIInChI=1S/C22H44N4O/c1-19(24-10-6-21(7-11-24)23(4)5)18-20(2)25-12-8-22(3,9-13-25)26-14-16-27-17-15-26/h19-21H,6-18H2,1-5H3
InChIKeyHDVQJMHWKOPOSF-UHFFFAOYSA-N
XLogP2.37
TPSA22.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.62
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine?
The IUPAC name of N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine (CID 135257228) is N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine.
What is the SMILES notation for N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine?
The canonical SMILES for N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine is CC(CC(C)N1CCC(C)(N2CCOCC2)CC1)N1CCC(N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine?
The InChIKey is HDVQJMHWKOPOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44N4O/c1-19(24-10-6-21(7-11-24)23(4)5)18-20(2)25-12-8-22(3,9-13-25)26-14-16-27-17-15-26/h19-21H,6-18H2,1-5H3.
What are the key properties of N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine?
N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine has a molecular weight of 380.62 g/mol, XLogP of 2.37, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[4-(4-methyl-4-morpholin-4-ylpiperidin-1-yl)pentan-2-yl]piperidin-4-amine is sourced from PubChem (CID 135257228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).