1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide

C20H29FN4O3 — CID 6487869

IUPAC1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)NC1(C(=O)NCCN2CCOCC2)CCCCC1
InChIInChI=1S/C20H29FN4O3/c21-16-5-4-6-17(15-16)23-19(27)24-20(7-2-1-3-8-20)18(26)22-9-10-25-11-13-28-14-12-25/h4-6,15H,1-3,7-14H2,(H,22,26)(H2,23,24,27)
InChIKeyDLHFDAVFWZEJJK-UHFFFAOYSA-N
MW392.48 g/mol
LogP2.10
Rot. Bonds6

About 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide

1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide (PubChem CID 6487869) has the molecular formula C20H29FN4O3 and a molecular weight of 392.48 g/mol. Its IUPAC name is 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
PubChem CID6487869
Molecular FormulaC20H29FN4O3
Molecular Weight392.48 g/mol
Exact Mass392.22
IUPAC Name1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)NC1(C(=O)NCCN2CCOCC2)CCCCC1
InChIInChI=1S/C20H29FN4O3/c21-16-5-4-6-17(15-16)23-19(27)24-20(7-2-1-3-8-20)18(26)22-9-10-25-11-13-28-14-12-25/h4-6,15H,1-3,7-14H2,(H,22,26)(H2,23,24,27)
InChIKeyDLHFDAVFWZEJJK-UHFFFAOYSA-N
XLogP2.10
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(4-methylphenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
CID 3230448
N-(3-fluorophenyl)-2-(2-morpholin-4-ylethylamino)acetamide
CID 28583111
1-N'-(3-chlorophenyl)-1-N-(2-morpholin-4-ylethyl)cyclopropane-1,1-dicarboxamide
CID 108973663
1-N-(2-morpholin-4-ylethyl)-1-N'-[3-(trifluoromethyl)phenyl]cyclopropane-1,1-dicarboxamide
CID 108973686
1-N-(2-morpholin-4-ylethyl)-1-N'-phenylcyclopropane-1,1-dicarboxamide
CID 108973636
1-[3-(1-aminoethyl)phenyl]-3-(2-morpholin-4-ylethyl)urea
CID 61339652
1-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(3-fluorophenyl)urea
CID 55696768
3-fluoro-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
CID 48581644
1-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
CID 110408174
1-(3-fluorophenyl)-3-[[1-(hydroxymethyl)cyclohexyl]methyl]urea
CID 115683138
N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 674229
1-[1-(aminomethyl)cyclopentyl]-3-(3-fluorophenyl)urea
CID 63767680

Frequently Asked Questions

What is the IUPAC name of 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide (CID 6487869) is 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide is O=C(Nc1cccc(F)c1)NC1(C(=O)NCCN2CCOCC2)CCCCC1.
What is the InChIKey of 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide?
The InChIKey is DLHFDAVFWZEJJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29FN4O3/c21-16-5-4-6-17(15-16)23-19(27)24-20(7-2-1-3-8-20)18(26)22-9-10-25-11-13-28-14-12-25/h4-6,15H,1-3,7-14H2,(H,22,26)(H2,23,24,27).
What are the key properties of 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide?
1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide has a molecular weight of 392.48 g/mol, XLogP of 2.10, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-fluorophenyl)carbamoylamino]-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 6487869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).