4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide

C14H22N4O2 — CID 62939355

IUPAC4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide
SMILESCCCn1ccnc(NC2CCC(C(N)=O)CC2)c1=O
InChIInChI=1S/C14H22N4O2/c1-2-8-18-9-7-16-13(14(18)20)17-11-5-3-10(4-6-11)12(15)19/h7,9-11H,2-6,8H2,1H3,(H2,15,19)(H,16,17)
InChIKeyYDSQTSBGFUHGHC-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.11
Rot. Bonds5

About 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide

4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide (PubChem CID 62939355) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide
PubChem CID62939355
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide
SMILESCCCn1ccnc(NC2CCC(C(N)=O)CC2)c1=O
InChIInChI=1S/C14H22N4O2/c1-2-8-18-9-7-16-13(14(18)20)17-11-5-3-10(4-6-11)12(15)19/h7,9-11H,2-6,8H2,1H3,(H2,15,19)(H,16,17)
InChIKeyYDSQTSBGFUHGHC-UHFFFAOYSA-N
XLogP1.11
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide with MolForge

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Related Compounds

N-(2-amino-2-oxoethyl)-4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)cyclohexane-1-carboxamide
CID 69492524
N-(2-aminoethyl)-4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)cyclohexane-1-carboxamide
CID 69492528
N-(2-amino-2-oxoethyl)-4-(2-propan-2-yl-5,6-dihydro-4H-pyrimidin-1-yl)cyclohexane-1-carboxamide
CID 69527259
4-[(4-Methyl-3-oxopyrazin-2-yl)amino]cyclohexane-1-carboxamide
CID 55130606
1-Ethyl-3-[(2-methylcyclohexyl)amino]pyrazin-2-one
CID 55154872
1-Cyclopropyl-3-[(4-methylcyclohexyl)amino]pyrazin-2-one
CID 55155641
3-(1-Cyclohexylethylamino)-1-propan-2-ylpyrazin-2-one
CID 55155652
3-(1-Cyclohexylpropylamino)-1-ethylpyrazin-2-one
CID 55155653
1-Tert-butyl-3-[(4-methylcyclohexyl)amino]pyrazin-2-one
CID 55155831
1-Ethyl-3-[(3-methylcyclohexyl)amino]pyrazin-2-one
CID 55156604
3-(Cyclohexylmethylamino)-1-propylpyrazin-2-one
CID 55156798
3-[(2-Ethylcyclohexyl)amino]-1-propan-2-ylpyrazin-2-one
CID 55157565

Frequently Asked Questions

What is the IUPAC name of 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide?
The IUPAC name of 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide (CID 62939355) is 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide?
The canonical SMILES for 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide is CCCn1ccnc(NC2CCC(C(N)=O)CC2)c1=O.
What is the InChIKey of 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide?
The InChIKey is YDSQTSBGFUHGHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-2-8-18-9-7-16-13(14(18)20)17-11-5-3-10(4-6-11)12(15)19/h7,9-11H,2-6,8H2,1H3,(H2,15,19)(H,16,17).
What are the key properties of 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide?
4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-oxo-4-propylpyrazin-2-yl)amino]cyclohexane-1-carboxamide is sourced from PubChem (CID 62939355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).