1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine

C15H25N3 — CID 43748322

IUPAC1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine
SMILESCCCCN1CCC(NCc2ccccn2)CC1
InChIInChI=1S/C15H25N3/c1-2-3-10-18-11-7-14(8-12-18)17-13-15-6-4-5-9-16-15/h4-6,9,14,17H,2-3,7-8,10-13H2,1H3
InChIKeyJIMCAVPHZJNDEC-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.44
Rot. Bonds6

About 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine

1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine (PubChem CID 43748322) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine
PubChem CID43748322
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine
SMILESCCCCN1CCC(NCc2ccccn2)CC1
InChIInChI=1S/C15H25N3/c1-2-3-10-18-11-7-14(8-12-18)17-13-15-6-4-5-9-16-15/h4-6,9,14,17H,2-3,7-8,10-13H2,1H3
InChIKeyJIMCAVPHZJNDEC-UHFFFAOYSA-N
XLogP2.44
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-N-(pyridin-2-ylmethyl)azepan-4-amine
CID 65072640
1-methyl-N-(pyridin-2-ylmethyl)azepan-4-amine
CID 65071092
ethane;N-(pyridin-2-ylmethyl)cyclopropanamine
CID 144801835
1-ethylsulfonyl-N-(pyridin-2-ylmethyl)piperidin-4-amine
CID 28731283
N-[(1-methylimidazol-4-yl)methyl]-1-(pyridin-2-ylmethyl)piperidin-4-amine
CID 100675626
4-methyl-N-(pyridin-2-ylmethyl)cycloheptan-1-amine
CID 65080736
1-butyl-N-[(1-ethylimidazol-2-yl)methyl]piperidin-4-amine
CID 62350120
iodoethane;1-N,3-N,5-N-tris(pyridin-2-ylmethyl)cyclohexane-1,3,5-triamine
CID 159564484
cyclopropyl-[4-(pyridin-2-ylmethylamino)piperidin-1-yl]methanone
CID 43434771
2-(4-propan-2-ylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)ethanamine
CID 103503493
N-propyl-1-(pyridin-2-ylmethyl)pyrrolidin-3-amine
CID 60860967
1-butyl-N-[(1-ethylpyrrol-2-yl)methyl]piperidin-4-amine
CID 66412732

Frequently Asked Questions

What is the IUPAC name of 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine?
The IUPAC name of 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine (CID 43748322) is 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine.
What is the SMILES notation for 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine?
The canonical SMILES for 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine is CCCCN1CCC(NCc2ccccn2)CC1.
What is the InChIKey of 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine?
The InChIKey is JIMCAVPHZJNDEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-2-3-10-18-11-7-14(8-12-18)17-13-15-6-4-5-9-16-15/h4-6,9,14,17H,2-3,7-8,10-13H2,1H3.
What are the key properties of 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine?
1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine has a molecular weight of 247.39 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-N-(pyridin-2-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 43748322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).