5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide

C17H21N3O — CID 61040317

IUPAC5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)N(C)CCCc1ccccc1
InChIInChI=1S/C17H21N3O/c1-13-16(11-15(18)12-19-13)17(21)20(2)10-6-9-14-7-4-3-5-8-14/h3-5,7-8,11-12H,6,9-10,18H2,1-2H3
InChIKeyFRKBMDJMAZOUKT-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.68
Rot. Bonds5

About 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide

5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide (PubChem CID 61040317) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide
PubChem CID61040317
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)N(C)CCCc1ccccc1
InChIInChI=1S/C17H21N3O/c1-13-16(11-15(18)12-19-13)17(21)20(2)10-6-9-14-7-4-3-5-8-14/h3-5,7-8,11-12H,6,9-10,18H2,1-2H3
InChIKeyFRKBMDJMAZOUKT-UHFFFAOYSA-N
XLogP2.68
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-benzyl-2-methyl-N-propylpyridine-3-carboxamide
CID 61040072
5-amino-N,2-dimethyl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 54916915
5-amino-N-[(2-chlorophenyl)methyl]-N,2-dimethylpyridine-3-carboxamide
CID 61117952
5-amino-N-benzyl-2-methylpyridine-3-carboxamide
CID 54917003
5-amino-N-[(2-methoxyphenyl)methyl]-N,2-dimethylpyridine-3-carboxamide
CID 61112841
5-[methyl(3-phenylpropyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120688951
2-fluoro-N,5-dimethyl-N-(3-phenylpropyl)benzamide
CID 62511119
4-amino-N,1-dimethyl-N-(3-phenylpropyl)pyrrole-2-carboxamide
CID 43644054
3-amino-N-methyl-N-(4-phenylbutyl)benzamide;hydrochloride
CID 119733712
5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpyridine-3-carboxamide
CID 61113866
2,4-diamino-N-methyl-N-(2-phenylethyl)benzamide
CID 61107981
3-amino-N-methyl-N-(3-phenylpropyl)-1H-1,2,4-triazole-5-carboxamide
CID 55115524

Frequently Asked Questions

What is the IUPAC name of 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide?
The IUPAC name of 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide (CID 61040317) is 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide?
The canonical SMILES for 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide is Cc1ncc(N)cc1C(=O)N(C)CCCc1ccccc1.
What is the InChIKey of 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide?
The InChIKey is FRKBMDJMAZOUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-13-16(11-15(18)12-19-13)17(21)20(2)10-6-9-14-7-4-3-5-8-14/h3-5,7-8,11-12H,6,9-10,18H2,1-2H3.
What are the key properties of 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide?
5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide has a molecular weight of 283.38 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N,2-dimethyl-N-(3-phenylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 61040317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).