1-butyl-N-methylpiperidin-3-amine

C10H22N2 — CID 62534430

IUPAC1-butyl-N-methylpiperidin-3-amine
SMILESCCCCN1CCCC(NC)C1
InChIInChI=1S/C10H22N2/c1-3-4-7-12-8-5-6-10(9-12)11-2/h10-11H,3-9H2,1-2H3
InChIKeyUCIONPCCLOKGQD-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.47
Rot. Bonds4

About 1-butyl-N-methylpiperidin-3-amine

1-butyl-N-methylpiperidin-3-amine (PubChem CID 62534430) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-butyl-N-methylpiperidin-3-amine.

Molecular Properties

Compound Name1-butyl-N-methylpiperidin-3-amine
PubChem CID62534430
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1-butyl-N-methylpiperidin-3-amine
SMILESCCCCN1CCCC(NC)C1
InChIInChI=1S/C10H22N2/c1-3-4-7-12-8-5-6-10(9-12)11-2/h10-11H,3-9H2,1-2H3
InChIKeyUCIONPCCLOKGQD-UHFFFAOYSA-N
XLogP1.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-ethylsulfanylethyl)-N-methylpiperidin-3-amine
CID 115741362
N-(1-heptylpiperidin-3-yl)acetamide
CID 21122308
1-butyl-3-methylpiperidine;ethane
CID 143349503
3-bromo-1-butylpiperidine
CID 14569986
N-benzyl-1-butylpiperidin-3-amine
CID 83993554
1-(iodomethyl)-N-methylpiperidin-3-amine
CID 89092988
butane;N,1-dimethylpiperidin-3-amine
CID 91437867
1-(2-cyclohexylethyl)-N-methylpiperidin-3-amine;hydrochloride
CID 119919012
N-methyl-1-propylazepan-4-amine
CID 65072873
N-[2-[3-(methylamino)piperidin-1-yl]ethyl]ethanesulfonamide;hydrochloride
CID 119920149
N-methyl-1-(2-propoxyethyl)pyrrolidin-3-amine
CID 106455097
1-butyl-N-(9H-xanthen-9-yl)piperidin-3-amine
CID 21482838

Frequently Asked Questions

What is the IUPAC name of 1-butyl-N-methylpiperidin-3-amine?
The IUPAC name of 1-butyl-N-methylpiperidin-3-amine (CID 62534430) is 1-butyl-N-methylpiperidin-3-amine.
What is the SMILES notation for 1-butyl-N-methylpiperidin-3-amine?
The canonical SMILES for 1-butyl-N-methylpiperidin-3-amine is CCCCN1CCCC(NC)C1.
What is the InChIKey of 1-butyl-N-methylpiperidin-3-amine?
The InChIKey is UCIONPCCLOKGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-3-4-7-12-8-5-6-10(9-12)11-2/h10-11H,3-9H2,1-2H3.
What are the key properties of 1-butyl-N-methylpiperidin-3-amine?
1-butyl-N-methylpiperidin-3-amine has a molecular weight of 170.30 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-N-methylpiperidin-3-amine is sourced from PubChem (CID 62534430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).