4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide

C15H24N4O — CID 63241227

IUPAC4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide
SMILESCC(C)NCC1CCCN(c2ccnc(C(N)=O)c2)C1
InChIInChI=1S/C15H24N4O/c1-11(2)18-9-12-4-3-7-19(10-12)13-5-6-17-14(8-13)15(16)20/h5-6,8,11-12,18H,3-4,7,9-10H2,1-2H3,(H2,16,20)
InChIKeyBGIXQTPLRYYBJN-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.39
Rot. Bonds5

About 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide

4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide (PubChem CID 63241227) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide
PubChem CID63241227
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide
SMILESCC(C)NCC1CCCN(c2ccnc(C(N)=O)c2)C1
InChIInChI=1S/C15H24N4O/c1-11(2)18-9-12-4-3-7-19(10-12)13-5-6-17-14(8-13)15(16)20/h5-6,8,11-12,18H,3-4,7,9-10H2,1-2H3,(H2,16,20)
InChIKeyBGIXQTPLRYYBJN-UHFFFAOYSA-N
XLogP1.39
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-3-carboxamide
CID 63241496
N-methyl-4-[3-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide
CID 63853891
4-[3-(2-amino-2-oxoethyl)piperidin-1-yl]-N-benzylpyridine-2-carboxamide
CID 133355871
N-butan-2-yl-4-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 109203312
4-[3-[[[3-(difluoromethyl)-1-methylpyrazole-5-carbonyl]amino]methyl]piperidin-1-yl]pyridine-2-carboxylic acid
CID 131927487
4-[3-(methylcarbamoyl)pyrrolidin-1-yl]pyridine-2-carboxamide
CID 171704184
4-[4-[(2R)-2-hydroxypropyl]piperazin-1-yl]pyridine-2-carboxamide
CID 133499674
4-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylpyridine-2-carboxamide
CID 124749236
4-[4-(cyclopentylmethyl)-3-oxopiperazin-1-yl]pyridine-2-carboxamide
CID 75509698
N-[(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)methyl]propan-2-amine
CID 62588134
N-ethyl-4-(3-hydroxypiperidin-1-yl)pyridine-2-carboxamide
CID 60551992
N-ethyl-4-[3-[1-(methylamino)ethyl]piperidin-1-yl]pyridine-2-carboxamide
CID 63853530

Frequently Asked Questions

What is the IUPAC name of 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide?
The IUPAC name of 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide (CID 63241227) is 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide.
What is the SMILES notation for 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide?
The canonical SMILES for 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide is CC(C)NCC1CCCN(c2ccnc(C(N)=O)c2)C1.
What is the InChIKey of 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide?
The InChIKey is BGIXQTPLRYYBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-11(2)18-9-12-4-3-7-19(10-12)13-5-6-17-14(8-13)15(16)20/h5-6,8,11-12,18H,3-4,7,9-10H2,1-2H3,(H2,16,20).
What are the key properties of 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide?
4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyridine-2-carboxamide is sourced from PubChem (CID 63241227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).