(2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide

C15H22N4O2 — CID 125008665

IUPAC(2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide
SMILESCc1ccc(C(=O)N2CCN(C(C)C)[C@@H](C(N)=O)C2)cn1
InChIInChI=1S/C15H22N4O2/c1-10(2)19-7-6-18(9-13(19)14(16)20)15(21)12-5-4-11(3)17-8-12/h4-5,8,10,13H,6-7,9H2,1-3H3,(H2,16,20)/t13-/m1/s1
InChIKeyUWTJUYGUFQACFB-CYBMUJFWSA-N
MW290.37 g/mol
LogP0.41
Rot. Bonds3

About (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide

(2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide (PubChem CID 125008665) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide.

Molecular Properties

Compound Name(2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide
PubChem CID125008665
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name(2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide
SMILESCc1ccc(C(=O)N2CCN(C(C)C)[C@@H](C(N)=O)C2)cn1
InChIInChI=1S/C15H22N4O2/c1-10(2)19-7-6-18(9-13(19)14(16)20)15(21)12-5-4-11(3)17-8-12/h4-5,8,10,13H,6-7,9H2,1-3H3,(H2,16,20)/t13-/m1/s1
InChIKeyUWTJUYGUFQACFB-CYBMUJFWSA-N
XLogP0.41
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-4-[2-(dimethylamino)pyrimidine-5-carbonyl]-1-propan-2-ylpiperazine-2-carboxamide
CID 95811305
(2S)-4-(4-fluorobenzoyl)-1-propan-2-ylpiperazine-2-carboxamide
CID 125016909
(2S)-1-benzyl-4-(6-methylpyridine-3-carbonyl)piperazine-2-carboxamide
CID 124944737
(3S,4S)-4-methyl-1-(6-methylpyridine-3-carbonyl)pyrrolidine-3-carboxamide
CID 128984202
(6-methyl-3-pyridinyl)-(3-methylpyrrolidin-1-yl)methanone
CID 144534976
(3-aminoazetidin-1-yl)-(6-methyl-3-pyridinyl)methanone
CID 63753826
[4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]-(4-propan-2-ylphenyl)methanone
CID 39991441
(2S)-1-acetyl-N,N-dimethyl-4-(6-methylpyridine-3-carbonyl)piperazine-2-carboxamide
CID 124967207
[3-(methylamino)pyrrolidin-1-yl]-(6-methyl-3-pyridinyl)methanone;dihydrochloride
CID 119413830
1-N-[(3R)-1-(6-methylpyridine-3-carbonyl)pyrrolidin-3-yl]piperidine-1,3-dicarboxamide
CID 154456800
4-methyl-1-(6-methylpyridine-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 63721715
2-[4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]ethanethioamide
CID 55203104

Frequently Asked Questions

What is the IUPAC name of (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide?
The IUPAC name of (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide (CID 125008665) is (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide.
What is the SMILES notation for (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide?
The canonical SMILES for (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide is Cc1ccc(C(=O)N2CCN(C(C)C)[C@@H](C(N)=O)C2)cn1.
What is the InChIKey of (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide?
The InChIKey is UWTJUYGUFQACFB-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-10(2)19-7-6-18(9-13(19)14(16)20)15(21)12-5-4-11(3)17-8-12/h4-5,8,10,13H,6-7,9H2,1-3H3,(H2,16,20)/t13-/m1/s1.
What are the key properties of (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide?
(2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 0.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(6-methylpyridine-3-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide is sourced from PubChem (CID 125008665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).