N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide

C15H17N3O — CID 55176966

IUPACN-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide
SMILESCc1cccnc1C(=O)NCC(N)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-11-6-5-9-17-14(11)15(19)18-10-13(16)12-7-3-2-4-8-12/h2-9,13H,10,16H2,1H3,(H,18,19)
InChIKeyJSADVWHCVCKVLA-UHFFFAOYSA-N
MW255.32 g/mol
LogP1.82
Rot. Bonds4

About N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide

N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide (PubChem CID 55176966) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide
PubChem CID55176966
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide
SMILESCc1cccnc1C(=O)NCC(N)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-11-6-5-9-17-14(11)15(19)18-10-13(16)12-7-3-2-4-8-12/h2-9,13H,10,16H2,1H3,(H,18,19)
InChIKeyJSADVWHCVCKVLA-UHFFFAOYSA-N
XLogP1.82
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-phenylethyl)-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 119527886
methyl 2-hydroxy-3-[(3-methylpyridine-2-carbonyl)amino]propanoate
CID 113358708
3-amino-N-(2-phenylpropyl)pyridine-2-carboxamide
CID 104742039
(2-amino-2-phenylethyl)carbamic acid
CID 66941802
N-(1-aminoethyl)-3-methylpyridine-2-carboxamide
CID 173067121
3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide
CID 81479287
N-(2-amino-2-phenylethyl)-3,4-dimethylbenzamide
CID 63120465
N-(2-amino-2-phenylethyl)-3-fluoro-4-methylbenzamide
CID 63120380
N-(2-chloro-4-methylpentyl)-3-methylpyridine-2-carboxamide
CID 107157408
N-(2-amino-2-phenylethyl)-3-methylthiophene-2-carboxamide
CID 63120577
2-amino-N-[(3-methyl-2-pyridinyl)methyl]-2-phenylacetamide
CID 63306151
N-(2-amino-2-phenylethyl)-2-(2,6-dimethylphenoxy)acetamide
CID 119529545

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide?
The IUPAC name of N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide (CID 55176966) is N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide?
The canonical SMILES for N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide is Cc1cccnc1C(=O)NCC(N)c1ccccc1.
What is the InChIKey of N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide?
The InChIKey is JSADVWHCVCKVLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-11-6-5-9-17-14(11)15(19)18-10-13(16)12-7-3-2-4-8-12/h2-9,13H,10,16H2,1H3,(H,18,19).
What are the key properties of N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide?
N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide is sourced from PubChem (CID 55176966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).