(1-butyl-4-methylpiperidin-2-yl)methanamine

C11H24N2 — CID 63839555

IUPAC(1-butyl-4-methylpiperidin-2-yl)methanamine
SMILESCCCCN1CCC(C)CC1CN
InChIInChI=1S/C11H24N2/c1-3-4-6-13-7-5-10(2)8-11(13)9-12/h10-11H,3-9,12H2,1-2H3
InChIKeyZWKLMDWNGKRQCB-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.85
Rot. Bonds4

About (1-butyl-4-methylpiperidin-2-yl)methanamine

(1-butyl-4-methylpiperidin-2-yl)methanamine (PubChem CID 63839555) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is (1-butyl-4-methylpiperidin-2-yl)methanamine.

Molecular Properties

Compound Name(1-butyl-4-methylpiperidin-2-yl)methanamine
PubChem CID63839555
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name(1-butyl-4-methylpiperidin-2-yl)methanamine
SMILESCCCCN1CCC(C)CC1CN
InChIInChI=1S/C11H24N2/c1-3-4-6-13-7-5-10(2)8-11(13)9-12/h10-11H,3-9,12H2,1-2H3
InChIKeyZWKLMDWNGKRQCB-UHFFFAOYSA-N
XLogP1.85
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-methyl-1-(4-methylpentyl)piperidin-2-yl]methanamine
CID 83158891
[1-(3,3-dimethylbutyl)-4-methylpiperidin-2-yl]methanamine
CID 63841352
2-[2-(aminomethyl)-4-methylpiperidin-1-yl]-N,N-dimethylethanamine
CID 63840214
5-[2-(aminomethyl)-4-methylpiperidin-1-yl]-2,2-dimethylpentanenitrile
CID 103441934
(4-methoxy-1-nonylpiperidin-2-yl)methanamine
CID 112622577
(1-butylazepan-2-yl)methanamine
CID 116640391
[4-methyl-1-[2-(trifluoromethylsulfanyl)ethyl]piperidin-2-yl]methanamine
CID 103441948
[4-methyl-1-[2-(3-methylbutoxy)ethyl]piperidin-2-yl]methanamine
CID 63841522
(1-nonylpyrrolidin-2-yl)methanamine
CID 19780174
[1-[(E)-3-chloroprop-2-enyl]-4-methylpiperidin-2-yl]methanamine
CID 103441569
(1-dodecylpiperidin-2-yl)methanamine
CID 63405140
[1-[2-(4-methoxyphenyl)ethyl]-4-methylpiperidin-2-yl]methanamine
CID 65446764

Frequently Asked Questions

What is the IUPAC name of (1-butyl-4-methylpiperidin-2-yl)methanamine?
The IUPAC name of (1-butyl-4-methylpiperidin-2-yl)methanamine (CID 63839555) is (1-butyl-4-methylpiperidin-2-yl)methanamine.
What is the SMILES notation for (1-butyl-4-methylpiperidin-2-yl)methanamine?
The canonical SMILES for (1-butyl-4-methylpiperidin-2-yl)methanamine is CCCCN1CCC(C)CC1CN.
What is the InChIKey of (1-butyl-4-methylpiperidin-2-yl)methanamine?
The InChIKey is ZWKLMDWNGKRQCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-3-4-6-13-7-5-10(2)8-11(13)9-12/h10-11H,3-9,12H2,1-2H3.
What are the key properties of (1-butyl-4-methylpiperidin-2-yl)methanamine?
(1-butyl-4-methylpiperidin-2-yl)methanamine has a molecular weight of 184.33 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-butyl-4-methylpiperidin-2-yl)methanamine is sourced from PubChem (CID 63839555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).