3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide

C19H22N2O2 — CID 119673239

IUPAC3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide
SMILESNC1CCCC(C(=O)Nc2cccc(Oc3ccccc3)c2)C1
InChIInChI=1S/C19H22N2O2/c20-15-7-4-6-14(12-15)19(22)21-16-8-5-11-18(13-16)23-17-9-2-1-3-10-17/h1-3,5,8-11,13-15H,4,6-7,12,20H2,(H,21,22)
InChIKeyMUFJEULONXELSR-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.93
Rot. Bonds4

About 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide

3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide (PubChem CID 119673239) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide
PubChem CID119673239
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide
SMILESNC1CCCC(C(=O)Nc2cccc(Oc3ccccc3)c2)C1
InChIInChI=1S/C19H22N2O2/c20-15-7-4-6-14(12-15)19(22)21-16-8-5-11-18(13-16)23-17-9-2-1-3-10-17/h1-3,5,8-11,13-15H,4,6-7,12,20H2,(H,21,22)
InChIKeyMUFJEULONXELSR-UHFFFAOYSA-N
XLogP3.93
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-(3-phenoxyphenyl)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

3-amino-N-(3-pyridin-2-yloxyphenyl)cyclohexane-1-carboxamide
CID 119884838
3-[4-[(3-aminocyclohexanecarbonyl)amino]phenoxy]benzamide
CID 119779656
cis-(1R,3S)-3-amino-N-[4-(3-methoxyphenoxy)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 154915202
3-amino-N-(3-ethoxyphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119708471
3-amino-N-(3-butan-2-yloxyphenyl)cyclohexane-1-carboxamide
CID 63044900
3-amino-N-[3-(cyanomethoxy)phenyl]cyclohexane-1-carboxamide
CID 63044296
3-amino-N-[3-(2-fluoroethoxy)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119808982
N-[3-[(3-aminocyclohexanecarbonyl)amino]phenyl]benzamide;hydrochloride
CID 119709587
3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide
CID 63043411
3-amino-N-[(3-phenoxyphenyl)methyl]cyclohexane-1-carboxamide;hydrochloride
CID 119732512
cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide
CID 56906171
3-amino-N-(3-cyanophenyl)cyclohexane-1-carboxamide
CID 63042853

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide (CID 119673239) is 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide is NC1CCCC(C(=O)Nc2cccc(Oc3ccccc3)c2)C1.
What is the InChIKey of 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide?
The InChIKey is MUFJEULONXELSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c20-15-7-4-6-14(12-15)19(22)21-16-8-5-11-18(13-16)23-17-9-2-1-3-10-17/h1-3,5,8-11,13-15H,4,6-7,12,20H2,(H,21,22).
What are the key properties of 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide?
3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 3.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-phenoxyphenyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 119673239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).