5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide

C15H17N3O — CID 93467775

IUPAC5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)N[C@@H](C)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-10(12-6-4-3-5-7-12)18-15(19)14-8-13(16)9-17-11(14)2/h3-10H,16H2,1-2H3,(H,18,19)/t10-/m0/s1
InChIKeyQPPJRCVIGKKWOT-JTQLQIEISA-N
MW255.32 g/mol
LogP2.46
Rot. Bonds3

About 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide

5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide (PubChem CID 93467775) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide
PubChem CID93467775
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)N[C@@H](C)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-10(12-6-4-3-5-7-12)18-15(19)14-8-13(16)9-17-11(14)2/h3-10H,16H2,1-2H3,(H,18,19)/t10-/m0/s1
InChIKeyQPPJRCVIGKKWOT-JTQLQIEISA-N
XLogP2.46
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-[1-(4-ethylphenyl)ethyl]-2-methylpyridine-3-carboxamide
CID 61139068
5-amino-2-methyl-N-[1-(2-methylphenyl)ethyl]pyridine-3-carboxamide
CID 61118673
5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide
CID 61117008
5-amino-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-methylpyridine-3-carboxamide
CID 107861835
5-amino-2-(dimethylamino)-N-[(1S)-1-phenylethyl]benzamide
CID 107863882
5-amino-2-methyl-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 61040068
5-amino-2-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 54917395
[6-amino-5-(1-phenylethylcarbamoyl)-3-pyridinyl]boronic acid
CID 141461249
5-amino-2-methyl-N-(2-methylsulfanylphenyl)pyridine-3-carboxamide
CID 61117272
5-amino-N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpyridine-3-carboxamide
CID 54917105
2-amino-3-methyl-N-[(1R)-1-phenylethyl]benzamide
CID 30117627
2-methyl-N-[(1R)-1-phenylethyl]benzamide
CID 681346

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide (CID 93467775) is 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide is Cc1ncc(N)cc1C(=O)N[C@@H](C)c1ccccc1.
What is the InChIKey of 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide?
The InChIKey is QPPJRCVIGKKWOT-JTQLQIEISA-N. The full InChI is InChI=1S/C15H17N3O/c1-10(12-6-4-3-5-7-12)18-15(19)14-8-13(16)9-17-11(14)2/h3-10H,16H2,1-2H3,(H,18,19)/t10-/m0/s1.
What are the key properties of 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide?
5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide is sourced from PubChem (CID 93467775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).