1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide

C20H36N4O3 — CID 3230436

IUPAC1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
SMILESO=C(NC1CCCCC1)NC1(C(=O)NCCN2CCOCC2)CCCCC1
InChIInChI=1S/C20H36N4O3/c25-18(21-11-12-24-13-15-27-16-14-24)20(9-5-2-6-10-20)23-19(26)22-17-7-3-1-4-8-17/h17H,1-16H2,(H,21,25)(H2,22,23,26)
InChIKeyNOBMJJMPWYBJQB-UHFFFAOYSA-N
MW380.53 g/mol
LogP1.77
Rot. Bonds6

About 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide

1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide (PubChem CID 3230436) has the molecular formula C20H36N4O3 and a molecular weight of 380.53 g/mol. Its IUPAC name is 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
PubChem CID3230436
Molecular FormulaC20H36N4O3
Molecular Weight380.53 g/mol
Exact Mass380.28
IUPAC Name1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
SMILESO=C(NC1CCCCC1)NC1(C(=O)NCCN2CCOCC2)CCCCC1
InChIInChI=1S/C20H36N4O3/c25-18(21-11-12-24-13-15-27-16-14-24)20(9-5-2-6-10-20)23-19(26)22-17-7-3-1-4-8-17/h17H,1-16H2,(H,21,25)(H2,22,23,26)
InChIKeyNOBMJJMPWYBJQB-UHFFFAOYSA-N
XLogP1.77
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.53
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-((1S)-2-((4-cyano-1-methylpiperidin-4-yl)amino)-1-(cyclohexylmethyl)-2-oxoethyl)morpholine-4-carboxamide
CID 9887557
N-[(2S)-1-[(4-cyano-1-methylpiperidin-4-yl)amino]-5,5-dimethyl-1-oxoheptan-2-yl]morpholine-4-carboxamide
CID 10409137
1,3-Diazaspiro(4.5)decane-2,4-dione, 3-(morpholinomethyl)-
CID 70178
1-(3-Cyclohexyl-ureido)-cyclohexanecarboxylic acid (3-morpholin-4-yl-propyl)-amide
CID 648415
4-methyl-N-(3-methyl-1-{[3-(morpholin-4-yl)propyl]amino}-1-oxobutan-2-yl)cyclohexanecarboxamide
CID 3243058
Morpholine-4-carboxylic acid {1-[(cyano-dimethyl-methyl)-carbamoyl]-2-cyclohexyl-ethyl}-amide
CID 10893503
N-[(2S)-1-[(1-cyanocyclopropyl)amino]-3-cyclohexyl-1-oxopropan-2-yl]morpholine-4-carboxamide
CID 71450699
Ethyl 1-[1-(cyclohexylcarbamoylamino)cyclohexanecarbonyl]piperidine-4-carboxylate
CID 3230434
N~2~-[(4-methylcyclohexyl)carbonyl]-N-[2-(morpholin-4-yl)ethyl]leucinamide
CID 16478659
N-[(2S)-3-cyclohexyl-1-[(4-methanimidoyl-1-methylpiperidin-1-ium-4-yl)amino]-1-oxopropan-2-yl]morpholine-4-carboxamide
CID 78224774
N-[2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-oxoethyl]cyclohexanecarboxamide
CID 25163204
1-acetamido-N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclohexane-1-carboxamide
CID 71880006

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide (CID 3230436) is 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide is O=C(NC1CCCCC1)NC1(C(=O)NCCN2CCOCC2)CCCCC1.
What is the InChIKey of 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide?
The InChIKey is NOBMJJMPWYBJQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36N4O3/c25-18(21-11-12-24-13-15-27-16-14-24)20(9-5-2-6-10-20)23-19(26)22-17-7-3-1-4-8-17/h17H,1-16H2,(H,21,25)(H2,22,23,26).
What are the key properties of 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide?
1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide has a molecular weight of 380.53 g/mol, XLogP of 1.77, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylcarbamoylamino)-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 3230436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).