N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide

C19H23N3O2 — CID 71087852

IUPACN-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide
SMILESCNC(=O)[C@H](CC(C)C)NC(=O)c1cccc(-c2ccccc2)n1
InChIInChI=1S/C19H23N3O2/c1-13(2)12-17(18(23)20-3)22-19(24)16-11-7-10-15(21-16)14-8-5-4-6-9-14/h4-11,13,17H,12H2,1-3H3,(H,20,23)(H,22,24)/t17-/m0/s1
InChIKeyNOTSKNXKSRDKGQ-KRWDZBQOSA-N
MW325.41 g/mol
LogP2.64
Rot. Bonds6

About N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide

N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide (PubChem CID 71087852) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide
PubChem CID71087852
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide
SMILESCNC(=O)[C@H](CC(C)C)NC(=O)c1cccc(-c2ccccc2)n1
InChIInChI=1S/C19H23N3O2/c1-13(2)12-17(18(23)20-3)22-19(24)16-11-7-10-15(21-16)14-8-5-4-6-9-14/h4-11,13,17H,12H2,1-3H3,(H,20,23)(H,22,24)/t17-/m0/s1
InChIKeyNOTSKNXKSRDKGQ-KRWDZBQOSA-N
XLogP2.64
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide?
The IUPAC name of N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide (CID 71087852) is N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide.
What is the SMILES notation for N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide?
The canonical SMILES for N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide is CNC(=O)[C@H](CC(C)C)NC(=O)c1cccc(-c2ccccc2)n1.
What is the InChIKey of N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide?
The InChIKey is NOTSKNXKSRDKGQ-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-13(2)12-17(18(23)20-3)22-19(24)16-11-7-10-15(21-16)14-8-5-4-6-9-14/h4-11,13,17H,12H2,1-3H3,(H,20,23)(H,22,24)/t17-/m0/s1.
What are the key properties of N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide?
N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-phenylpyridine-2-carboxamide is sourced from PubChem (CID 71087852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).