4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide

C18H24N4O — CID 109212707

IUPAC4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
SMILESCCCN(CCC)c1ccnc(C(=O)NCc2ccccn2)c1
InChIInChI=1S/C18H24N4O/c1-3-11-22(12-4-2)16-8-10-20-17(13-16)18(23)21-14-15-7-5-6-9-19-15/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,21,23)
InChIKeyQJDVILJNXVSRJS-UHFFFAOYSA-N
MW312.42 g/mol
LogP3.03
Rot. Bonds8

About 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide

4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 109212707) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
PubChem CID109212707
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC Name4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
SMILESCCCN(CCC)c1ccnc(C(=O)NCc2ccccn2)c1
InChIInChI=1S/C18H24N4O/c1-3-11-22(12-4-2)16-8-10-20-17(13-16)18(23)21-14-15-7-5-6-9-19-15/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,21,23)
InChIKeyQJDVILJNXVSRJS-UHFFFAOYSA-N
XLogP3.03
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(dipropylamino)-N-[(2-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109211971
4-[2-hydroxyethyl(propyl)amino]-N-methylpyridine-2-carboxamide
CID 61425976
4-[3-(dimethylamino)propylamino]-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 109207906
4-[4-(dimethylamino)anilino]-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 109212771
4-N-methyl-4-N-phenyl-2-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087239
4-N-methyl-4-N-(2-pyridin-4-ylethyl)-2-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087215
4-(propan-2-ylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 109201520
5-(diethylamino)-N-(pyridin-2-ylmethyl)pyrazine-2-carboxamide
CID 109282951
N-cyclopentyl-4-(dipropylamino)pyridine-2-carboxamide
CID 109204064
4-(3,5-dimethylanilino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 109212720
2-N-propyl-6-N-(pyridin-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109093458
N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 63038083

Frequently Asked Questions

What is the IUPAC name of 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide (CID 109212707) is 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide is CCCN(CCC)c1ccnc(C(=O)NCc2ccccn2)c1.
What is the InChIKey of 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is QJDVILJNXVSRJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c1-3-11-22(12-4-2)16-8-10-20-17(13-16)18(23)21-14-15-7-5-6-9-19-15/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,21,23).
What are the key properties of 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide?
4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 312.42 g/mol, XLogP of 3.03, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dipropylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 109212707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).