5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide

C19H25N3O — CID 109179150

IUPAC5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide
SMILESCCCNC(=O)c1ccc(Nc2c(C)cccc2C(C)C)cn1
InChIInChI=1S/C19H25N3O/c1-5-11-20-19(23)17-10-9-15(12-21-17)22-18-14(4)7-6-8-16(18)13(2)3/h6-10,12-13,22H,5,11H2,1-4H3,(H,20,23)
InChIKeyGKGMMJFEXJJFTP-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.40
Rot. Bonds6

About 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide

5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide (PubChem CID 109179150) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide
PubChem CID109179150
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide
SMILESCCCNC(=O)c1ccc(Nc2c(C)cccc2C(C)C)cn1
InChIInChI=1S/C19H25N3O/c1-5-11-20-19(23)17-10-9-15(12-21-17)22-18-14(4)7-6-8-16(18)13(2)3/h6-10,12-13,22H,5,11H2,1-4H3,(H,20,23)
InChIKeyGKGMMJFEXJJFTP-UHFFFAOYSA-N
XLogP4.40
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylamino)ethyl]-5-(2-methyl-6-propan-2-ylanilino)pyridine-2-carboxamide
CID 109185373
N-tert-butyl-5-(2-methyl-6-propan-2-ylanilino)pyridine-2-carboxamide
CID 109195082
6-(2-methyl-6-propan-2-ylanilino)-N-propylpyrimidine-4-carboxamide
CID 109338546
N-[2,6-di(propan-2-yl)phenyl]-5-(propylamino)pyridine-2-carboxamide
CID 109179407
N-butyl-4-(2-methyl-6-propan-2-ylanilino)pyridine-2-carboxamide
CID 109202571
N-[5-(2-methyl-6-propan-2-ylanilino)-2-pyridinyl]butanamide
CID 113032871
ethyl N-[5-(2-methyl-6-propan-2-ylanilino)-2-pyridinyl]carbamate
CID 113032879
5-[2,6-di(propan-2-yl)anilino]-N-propylpyridine-3-carboxamide
CID 109222930
N-(2-methoxyethyl)-5-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109183920
5-(2,3-dimethylanilino)-N-(3-methylbutyl)pyridine-2-carboxamide
CID 109195520
N-butyl-6-(2-methyl-6-propan-2-ylanilino)pyridine-3-carboxamide
CID 109151740
5-(diethylamino)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109194754

Frequently Asked Questions

What is the IUPAC name of 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide?
The IUPAC name of 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide (CID 109179150) is 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide.
What is the SMILES notation for 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide?
The canonical SMILES for 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide is CCCNC(=O)c1ccc(Nc2c(C)cccc2C(C)C)cn1.
What is the InChIKey of 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide?
The InChIKey is GKGMMJFEXJJFTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-5-11-20-19(23)17-10-9-15(12-21-17)22-18-14(4)7-6-8-16(18)13(2)3/h6-10,12-13,22H,5,11H2,1-4H3,(H,20,23).
What are the key properties of 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide?
5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide has a molecular weight of 311.43 g/mol, XLogP of 4.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methyl-6-propan-2-ylanilino)-N-propylpyridine-2-carboxamide is sourced from PubChem (CID 109179150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).