2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide

C17H24N2O — CID 64596435

IUPAC2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NC1CCCC(C2CC2)C1
InChIInChI=1S/C17H24N2O/c18-17(20)11-14-4-1-2-7-16(14)19-15-6-3-5-13(10-15)12-8-9-12/h1-2,4,7,12-13,15,19H,3,5-6,8-11H2,(H2,18,20)
InChIKeyIRIMIKHCKIXHGD-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.10
Rot. Bonds5

About 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide

2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide (PubChem CID 64596435) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide.

Molecular Properties

Compound Name2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide
PubChem CID64596435
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NC1CCCC(C2CC2)C1
InChIInChI=1S/C17H24N2O/c18-17(20)11-14-4-1-2-7-16(14)19-15-6-3-5-13(10-15)12-8-9-12/h1-2,4,7,12-13,15,19H,3,5-6,8-11H2,(H2,18,20)
InChIKeyIRIMIKHCKIXHGD-UHFFFAOYSA-N
XLogP3.10
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(oxepan-4-ylamino)phenyl]acetamide
CID 65082099
N-(2-ethylphenyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 43764536
2-[2-(pyrrolidin-3-ylamino)phenyl]acetamide
CID 79731342
4-[2-(2-amino-2-oxoethyl)anilino]piperidine-1-carboxamide
CID 43789647
2-[2-[[4-(trifluoromethyl)cyclohexyl]amino]phenyl]acetamide
CID 64754665
N-(3-cyclopropylcyclohexyl)-2-fluoroaniline
CID 64595816
2-[2-[[(1S,3S)-3-methylcyclohexyl]carbamoylamino]phenyl]acetamide
CID 94060517
2-[2-[(3,3,5,5-tetramethylcyclohexyl)amino]phenyl]acetamide
CID 115998787
N-(2-amino-2-oxoethyl)-3-[[(1R,3S)-3-cyclopropylcyclohexyl]amino]benzamide
CID 97157129
2-[2-[(1-propylpiperidin-4-yl)amino]phenyl]acetamide
CID 43738460
1-N-(3-cyclopropylcyclohexyl)-2-N,2-N-dimethylbenzene-1,2-diamine
CID 64596233
3-[(3-cyclopropylcyclohexyl)amino]-N,2-dimethylbenzamide
CID 64596426

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide?
The IUPAC name of 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide (CID 64596435) is 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide.
What is the SMILES notation for 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide?
The canonical SMILES for 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide is NC(=O)Cc1ccccc1NC1CCCC(C2CC2)C1.
What is the InChIKey of 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide?
The InChIKey is IRIMIKHCKIXHGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c18-17(20)11-14-4-1-2-7-16(14)19-15-6-3-5-13(10-15)12-8-9-12/h1-2,4,7,12-13,15,19H,3,5-6,8-11H2,(H2,18,20).
What are the key properties of 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide?
2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide has a molecular weight of 272.39 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(3-cyclopropylcyclohexyl)amino]phenyl]acetamide is sourced from PubChem (CID 64596435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).