N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide

C18H23N3O — CID 109203139

IUPACN-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(NCC(C)C)ccn1
InChIInChI=1S/C18H23N3O/c1-4-14-7-5-6-8-16(14)21-18(22)17-11-15(9-10-19-17)20-12-13(2)3/h5-11,13H,4,12H2,1-3H3,(H,19,20)(H,21,22)
InChIKeyKLIMYWBARRYTAG-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.96
Rot. Bonds6

About N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide

N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide (PubChem CID 109203139) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide
PubChem CID109203139
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC NameN-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(NCC(C)C)ccn1
InChIInChI=1S/C18H23N3O/c1-4-14-7-5-6-8-16(14)21-18(22)17-11-15(9-10-19-17)20-12-13(2)3/h5-11,13H,4,12H2,1-3H3,(H,19,20)(H,21,22)
InChIKeyKLIMYWBARRYTAG-UHFFFAOYSA-N
XLogP3.96
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092181
N-(2-ethylphenyl)-5-(2-methylpropylamino)pyridine-3-carboxamide
CID 109225020
4-(3-acetylanilino)-N-(2-ethylphenyl)pyridine-2-carboxamide
CID 109220139
2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090820
N-[4-(dimethylamino)phenyl]-4-(2-methylpropylamino)pyridine-2-carboxamide
CID 109203188
N-(2-propan-2-ylphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 109201226
N-(4-bromophenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide
CID 109203163
N-(2-ethylphenyl)-4-[2-(3-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109214474
N-[4-(diethylamino)-2-methylphenyl]-4-(2-methylpropylamino)pyridine-2-carboxamide
CID 109203222
N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide
CID 109220187
N-(2-fluorophenyl)-4-(propylamino)pyridine-2-carboxamide
CID 62166215
methyl 4-chloro-3-[[4-(2-methylpropylamino)pyridine-2-carbonyl]amino]benzoate
CID 109203186

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide (CID 109203139) is N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide is CCc1ccccc1NC(=O)c1cc(NCC(C)C)ccn1.
What is the InChIKey of N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide?
The InChIKey is KLIMYWBARRYTAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-4-14-7-5-6-8-16(14)21-18(22)17-11-15(9-10-19-17)20-12-13(2)3/h5-11,13H,4,12H2,1-3H3,(H,19,20)(H,21,22).
What are the key properties of N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide?
N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide has a molecular weight of 297.40 g/mol, XLogP of 3.96, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109203139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).