2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine

C15H25N3 — CID 69036700

IUPAC2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine
SMILESCCC(CN)C1CCN(c2cccc(C)n2)CC1
InChIInChI=1S/C15H25N3/c1-3-13(11-16)14-7-9-18(10-8-14)15-6-4-5-12(2)17-15/h4-6,13-14H,3,7-11,16H2,1-2H3
InChIKeyVOEHFKOVOAQOBH-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.59
Rot. Bonds4

About 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine

2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine (PubChem CID 69036700) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine.

Molecular Properties

Compound Name2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine
PubChem CID69036700
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine
SMILESCCC(CN)C1CCN(c2cccc(C)n2)CC1
InChIInChI=1S/C15H25N3/c1-3-13(11-16)14-7-9-18(10-8-14)15-6-4-5-12(2)17-15/h4-6,13-14H,3,7-11,16H2,1-2H3
InChIKeyVOEHFKOVOAQOBH-UHFFFAOYSA-N
XLogP2.59
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-amine
CID 67001485
1-(6-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 133313226
2-(azetidin-1-yl)-6-methylpyridine
CID 54182749
ethyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]carbamic acid
CID 67136421
(3R)-1-(6-methyl-2-pyridinyl)pyrrolidin-3-ol
CID 103801636
methyl 1-(6-methyl-2-pyridinyl)piperidine-4-carboxylate
CID 62007370
ethane;N-methylmethanamine;2-methyl-6-pyrrolidin-1-ylpyridine
CID 156652479
ethane;4-(6-methyl-2-pyridinyl)morpholine
CID 143966353
azane;4-(6-methyl-2-pyridinyl)morpholine
CID 175085700
2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pentanethioamide
CID 63342588
4-benzyl-5-methyl-1-(6-methyl-2-pyridinyl)-1,4-diazepane
CID 133483690
5-chloro-N-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]pyrimidin-2-amine
CID 163345578

Frequently Asked Questions

What is the IUPAC name of 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine?
The IUPAC name of 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine (CID 69036700) is 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine.
What is the SMILES notation for 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine?
The canonical SMILES for 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine is CCC(CN)C1CCN(c2cccc(C)n2)CC1.
What is the InChIKey of 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine?
The InChIKey is VOEHFKOVOAQOBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-13(11-16)14-7-9-18(10-8-14)15-6-4-5-12(2)17-15/h4-6,13-14H,3,7-11,16H2,1-2H3.
What are the key properties of 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine?
2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine has a molecular weight of 247.39 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]butan-1-amine is sourced from PubChem (CID 69036700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).