5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide

C14H21ClN4O — CID 83023979

IUPAC5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncc(C(=O)NN2CCCCC2)cc1Cl
InChIInChI=1S/C14H21ClN4O/c1-2-6-16-13-12(15)9-11(10-17-13)14(20)18-19-7-4-3-5-8-19/h9-10H,2-8H2,1H3,(H,16,17)(H,18,20)
InChIKeyZQFXMGRHSGBSOR-UHFFFAOYSA-N
MW296.80 g/mol
LogP2.69
Rot. Bonds5

About 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide

5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide (PubChem CID 83023979) has the molecular formula C14H21ClN4O and a molecular weight of 296.80 g/mol. Its IUPAC name is 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide
PubChem CID83023979
Molecular FormulaC14H21ClN4O
Molecular Weight296.80 g/mol
Exact Mass296.14
IUPAC Name5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncc(C(=O)NN2CCCCC2)cc1Cl
InChIInChI=1S/C14H21ClN4O/c1-2-6-16-13-12(15)9-11(10-17-13)14(20)18-19-7-4-3-5-8-19/h9-10H,2-8H2,1H3,(H,16,17)(H,18,20)
InChIKeyZQFXMGRHSGBSOR-UHFFFAOYSA-N
XLogP2.69
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-cyclobutyl-6-(propylamino)pyridine-3-carboxamide
CID 62414075
N-tert-butyl-5-chloro-6-(propylamino)pyridine-3-carboxamide
CID 62171459
[5-chloro-6-(2-ethoxyethylamino)-3-pyridinyl]-piperidin-1-ylmethanone
CID 133271024
5-chloro-6-(propylamino)-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 62172627
[5-chloro-6-(propylamino)-3-pyridinyl]-(2-ethylpyrrolidin-1-yl)methanone
CID 62187046
azocan-1-yl-[5-chloro-6-(ethylamino)-3-pyridinyl]methanone
CID 62173335
[5-chloro-6-(ethylamino)-3-pyridinyl]-piperidin-1-ylmethanone
CID 60561390
N-(5-amino-5-oxopentyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide
CID 106241047
3,5-difluoro-N-piperidin-1-yl-4-(propylamino)benzamide
CID 83016826
5-chloro-N-methyl-N-propyl-6-(propylamino)pyridine-3-carboxamide
CID 55042480
5-chloro-N-(3-chlorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 25176417
5-chloro-6-(propylamino)-N-thiophen-3-ylpyridine-3-carboxamide
CID 66355264

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide (CID 83023979) is 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide is CCCNc1ncc(C(=O)NN2CCCCC2)cc1Cl.
What is the InChIKey of 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is ZQFXMGRHSGBSOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN4O/c1-2-6-16-13-12(15)9-11(10-17-13)14(20)18-19-7-4-3-5-8-19/h9-10H,2-8H2,1H3,(H,16,17)(H,18,20).
What are the key properties of 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide?
5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide has a molecular weight of 296.80 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 83023979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).