4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide

C19H25N3O — CID 109218313

IUPAC4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cc(Nc2cccc(C)c2)ccn1
InChIInChI=1S/C19H25N3O/c1-4-11-22(12-5-2)19(23)18-14-17(9-10-20-18)21-16-8-6-7-15(3)13-16/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,20,21)
InChIKeyHRRLTKWQAVKDNK-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.40
Rot. Bonds7

About 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide

4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide (PubChem CID 109218313) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide
PubChem CID109218313
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cc(Nc2cccc(C)c2)ccn1
InChIInChI=1S/C19H25N3O/c1-4-11-22(12-5-2)19(23)18-14-17(9-10-20-18)21-16-8-6-7-15(3)13-16/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,20,21)
InChIKeyHRRLTKWQAVKDNK-UHFFFAOYSA-N
XLogP4.40
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-acetamidoanilino)-N,N-dipropylpyridine-2-carboxamide
CID 109218356
N-butyl-N-methyl-4-(3-methylanilino)pyridine-2-carboxamide
CID 109217712
4-(2,6-difluoroanilino)-N,N-dipropylpyridine-2-carboxamide
CID 109218386
4-[4-(dimethylamino)anilino]-N,N-dipropylpyridine-2-carboxamide
CID 109218362
4-(2-fluoroanilino)-N,N-dipropylpyridine-2-carboxamide
CID 109218327
4-(3,4-dimethoxyanilino)-N,N-dipropylpyridine-2-carboxamide
CID 109218350
4-(3-acetamidoanilino)-N,N-diethylpyridine-2-carboxamide
CID 109216443
N,N-dipropyl-4-(4-pyrrolidin-1-ylanilino)pyridine-2-carboxamide
CID 109218364
4-hydrazinyl-N-(2-hydroxyethyl)-N-propylpyridine-2-carboxamide
CID 62249260
N,N-dipropyl-4-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109213420
2-N,2-N,4-N,4-N-tetrapropylpyridine-2,4-dicarboxamide
CID 109090449
2-N-ethyl-2-N-(3-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109090530

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide?
The IUPAC name of 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide (CID 109218313) is 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide.
What is the SMILES notation for 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide?
The canonical SMILES for 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide is CCCN(CCC)C(=O)c1cc(Nc2cccc(C)c2)ccn1.
What is the InChIKey of 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide?
The InChIKey is HRRLTKWQAVKDNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-4-11-22(12-5-2)19(23)18-14-17(9-10-20-18)21-16-8-6-7-15(3)13-16/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,20,21).
What are the key properties of 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide?
4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide has a molecular weight of 311.43 g/mol, XLogP of 4.40, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylanilino)-N,N-dipropylpyridine-2-carboxamide is sourced from PubChem (CID 109218313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).