3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide

C19H23N5O2 — CID 119132594

IUPAC3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide
SMILESCN(C(=O)c1ccc(NC(=O)c2nccnc2N)cc1)C1CCCCC1
InChIInChI=1S/C19H23N5O2/c1-24(15-5-3-2-4-6-15)19(26)13-7-9-14(10-8-13)23-18(25)16-17(20)22-12-11-21-16/h7-12,15H,2-6H2,1H3,(H2,20,22)(H,23,25)
InChIKeyJJDRUZIAOWGDMQ-UHFFFAOYSA-N
MW353.43 g/mol
LogP2.72
Rot. Bonds4

About 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide

3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide (PubChem CID 119132594) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide
PubChem CID119132594
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide
SMILESCN(C(=O)c1ccc(NC(=O)c2nccnc2N)cc1)C1CCCCC1
InChIInChI=1S/C19H23N5O2/c1-24(15-5-3-2-4-6-15)19(26)13-7-9-14(10-8-13)23-18(25)16-17(20)22-12-11-21-16/h7-12,15H,2-6H2,1H3,(H2,20,22)(H,23,25)
InChIKeyJJDRUZIAOWGDMQ-UHFFFAOYSA-N
XLogP2.72
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]-2-methylbenzamide
CID 120624848
N-cyclohexyl-N-methyl-4-[[4-[(1-methylimidazol-2-yl)methoxy]benzoyl]amino]benzamide
CID 55920263
N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 55920129
4-[[(2S)-2-amino-4-methylpentanoyl]amino]-N-cyclohexyl-N-methylbenzamide
CID 119743435
N-cyclohexyl-4-hydroxy-N-methylbenzamide
CID 43176625
N-cyclohexyl-4-(3-cyclopentylsulfonylpropanoylamino)-N-methylbenzamide
CID 55920389
3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide
CID 154749790
3-[cyclohexyl(methyl)carbamoyl]pyrazine-2-carboxylic acid
CID 53270971
4-(benzenesulfonamido)-N-cyclohexyl-N-methylbenzamide
CID 28567343
N-cyclohexyl-4-[[2-(cyclopropylmethylamino)acetyl]amino]-N-methylbenzamide;hydrochloride
CID 119743408
N-cyclohexyl-4-iodo-N-methylbenzamide
CID 30383969
3-(4-aminophenyl)-1-cycloheptyl-1-methylurea
CID 43614356

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide (CID 119132594) is 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide is CN(C(=O)c1ccc(NC(=O)c2nccnc2N)cc1)C1CCCCC1.
What is the InChIKey of 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide?
The InChIKey is JJDRUZIAOWGDMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-24(15-5-3-2-4-6-15)19(26)13-7-9-14(10-8-13)23-18(25)16-17(20)22-12-11-21-16/h7-12,15H,2-6H2,1H3,(H2,20,22)(H,23,25).
What are the key properties of 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide?
3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide has a molecular weight of 353.43 g/mol, XLogP of 2.72, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 119132594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).