3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine

C14H24N2 — CID 115872088

IUPAC3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine
SMILESCCCC(NCCC(C)C)c1ccccn1
InChIInChI=1S/C14H24N2/c1-4-7-13(16-11-9-12(2)3)14-8-5-6-10-15-14/h5-6,8,10,12-13,16H,4,7,9,11H2,1-3H3
InChIKeyBKJRHUXNEQIMRF-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.56
Rot. Bonds7

About 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine

3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine (PubChem CID 115872088) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine.

Molecular Properties

Compound Name3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine
PubChem CID115872088
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine
SMILESCCCC(NCCC(C)C)c1ccccn1
InChIInChI=1S/C14H24N2/c1-4-7-13(16-11-9-12(2)3)14-8-5-6-10-15-14/h5-6,8,10,12-13,16H,4,7,9,11H2,1-3H3
InChIKeyBKJRHUXNEQIMRF-UHFFFAOYSA-N
XLogP3.56
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(1-pyridin-2-ylbutyl)butane-1,4-diamine
CID 91082379
(E)-N-(1-pyridin-2-ylbutyl)pent-3-en-1-amine
CID 115890101
N-(3-methoxypropyl)-1-pyridin-2-ylbutan-1-amine
CID 115872086
N-ethyl-5-methyl-1-pyridin-2-ylhexan-1-amine
CID 83161018
(2R)-2-(1-pyridin-2-ylbutylamino)propan-1-ol
CID 103878434
N-ethyl-1-pyridin-2-ylhexan-1-amine
CID 62600130
4-ethylsulfonyl-N-propyl-1-pyridin-2-ylbutan-1-amine
CID 65095498
N-ethyl-1-pyridin-2-ylnonan-1-amine
CID 62600129
N-propyl-1-pyridin-2-yloct-7-en-1-amine
CID 107008851
N,4-dipropyl-2-pyridin-2-ylheptan-3-amine
CID 82987036
N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine
CID 81401489
N-ethyl-4,4-dimethyl-1-pyridin-2-ylpentan-1-amine
CID 62602048

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine?
The IUPAC name of 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine (CID 115872088) is 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine.
What is the SMILES notation for 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine?
The canonical SMILES for 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine is CCCC(NCCC(C)C)c1ccccn1.
What is the InChIKey of 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine?
The InChIKey is BKJRHUXNEQIMRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-4-7-13(16-11-9-12(2)3)14-8-5-6-10-15-14/h5-6,8,10,12-13,16H,4,7,9,11H2,1-3H3.
What are the key properties of 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine?
3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine has a molecular weight of 220.36 g/mol, XLogP of 3.56, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-pyridin-2-ylbutyl)butan-1-amine is sourced from PubChem (CID 115872088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).