2-methyl-1-piperidin-1-ylbutan-1-amine

C10H22N2 — CID 54574493

IUPAC2-methyl-1-piperidin-1-ylbutan-1-amine
SMILESCCC(C)C(N)N1CCCCC1
InChIInChI=1S/C10H22N2/c1-3-9(2)10(11)12-7-5-4-6-8-12/h9-10H,3-8,11H2,1-2H3
InChIKeyZUSPLVDTAQGDQU-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.80
Rot. Bonds3

About 2-methyl-1-piperidin-1-ylbutan-1-amine

2-methyl-1-piperidin-1-ylbutan-1-amine (PubChem CID 54574493) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 2-methyl-1-piperidin-1-ylbutan-1-amine.

Molecular Properties

Compound Name2-methyl-1-piperidin-1-ylbutan-1-amine
PubChem CID54574493
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name2-methyl-1-piperidin-1-ylbutan-1-amine
SMILESCCC(C)C(N)N1CCCCC1
InChIInChI=1S/C10H22N2/c1-3-9(2)10(11)12-7-5-4-6-8-12/h9-10H,3-8,11H2,1-2H3
InChIKeyZUSPLVDTAQGDQU-UHFFFAOYSA-N
XLogP1.80
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azepan-1-yl)pentan-3-amine
CID 16789073
(2S)-2-amino-3-methyl-N-(2-piperidin-1-ylpropyl)pentanamide
CID 61173580
3-methyl-2-pyrrolidin-1-ylpentanoic acid
CID 23008915
propan-2-amine;1-propan-2-ylpiperidine
CID 142245197
3-methyl-N-(2-pyrrolidin-1-ylbutyl)pentan-2-amine
CID 115709194
1-(4-piperidin-1-ylpentan-2-yl)piperidine
CID 174442116
1-(1-fluoropropyl)piperidine
CID 68907718
ethyl 2-piperidin-1-ylpropanoate;methanamine
CID 143433031
2-(azepan-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 62437423
cyclobutane;2,3-dimethylpentane
CID 145154125
ethyl 4-piperidin-1-ylpentanoate
CID 67188448
methoxymethane;1-propan-2-ylpiperidine
CID 153352735

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-piperidin-1-ylbutan-1-amine?
The IUPAC name of 2-methyl-1-piperidin-1-ylbutan-1-amine (CID 54574493) is 2-methyl-1-piperidin-1-ylbutan-1-amine.
What is the SMILES notation for 2-methyl-1-piperidin-1-ylbutan-1-amine?
The canonical SMILES for 2-methyl-1-piperidin-1-ylbutan-1-amine is CCC(C)C(N)N1CCCCC1.
What is the InChIKey of 2-methyl-1-piperidin-1-ylbutan-1-amine?
The InChIKey is ZUSPLVDTAQGDQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-3-9(2)10(11)12-7-5-4-6-8-12/h9-10H,3-8,11H2,1-2H3.
What are the key properties of 2-methyl-1-piperidin-1-ylbutan-1-amine?
2-methyl-1-piperidin-1-ylbutan-1-amine has a molecular weight of 170.30 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-piperidin-1-ylbutan-1-amine is sourced from PubChem (CID 54574493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).