N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide

C15H20ClN3O2 — CID 75393371

IUPACN-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide
SMILESCNC(=O)NCC(=O)NC1(c2cccc(Cl)c2)CCCC1
InChIInChI=1S/C15H20ClN3O2/c1-17-14(21)18-10-13(20)19-15(7-2-3-8-15)11-5-4-6-12(16)9-11/h4-6,9H,2-3,7-8,10H2,1H3,(H,19,20)(H2,17,18,21)
InChIKeyKYWCFZISZBGOTQ-UHFFFAOYSA-N
MW309.80 g/mol
LogP2.15
Rot. Bonds4

About N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide

N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide (PubChem CID 75393371) has the molecular formula C15H20ClN3O2 and a molecular weight of 309.80 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide
PubChem CID75393371
Molecular FormulaC15H20ClN3O2
Molecular Weight309.80 g/mol
Exact Mass309.12
IUPAC NameN-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide
SMILESCNC(=O)NCC(=O)NC1(c2cccc(Cl)c2)CCCC1
InChIInChI=1S/C15H20ClN3O2/c1-17-14(21)18-10-13(20)19-15(7-2-3-8-15)11-5-4-6-12(16)9-11/h4-6,9H,2-3,7-8,10H2,1H3,(H,19,20)(H2,17,18,21)
InChIKeyKYWCFZISZBGOTQ-UHFFFAOYSA-N
XLogP2.15
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 52.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[1-(3-chlorophenyl)cyclopentyl]acetamide
CID 110459406
N-[1-(3-chlorophenyl)cyclopentyl]acetamide
CID 110441196
1-[1-(3-chlorophenyl)cyclopropyl]-3-ethylurea
CID 110490719
7-amino-N-[1-(3-chlorophenyl)cyclopentyl]heptanamide;hydrochloride
CID 119815402
1-[1-(3-chlorophenyl)cyclopropyl]-3-(2-hydroxypropyl)urea
CID 110490727
[1-(3-chlorophenyl)cyclopropyl]carbamic acid
CID 122529573
N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide
CID 119764374
N-[1-(3-chlorophenyl)cyclopentyl]-4-(dimethylamino)benzamide
CID 110444472
N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide
CID 119799433
2-(methylcarbamoylamino)-N-[(1-phenylcycloheptyl)methyl]acetamide
CID 136518370
N-[1-(3-chlorophenyl)cyclopentyl]-1H-pyrazole-4-carboxamide
CID 136515658
4-[[1-(3-chlorophenyl)cyclopropyl]carbamoylamino]butanoic acid
CID 122023166

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide?
The IUPAC name of N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide (CID 75393371) is N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide.
What is the SMILES notation for N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide?
The canonical SMILES for N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide is CNC(=O)NCC(=O)NC1(c2cccc(Cl)c2)CCCC1.
What is the InChIKey of N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide?
The InChIKey is KYWCFZISZBGOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O2/c1-17-14(21)18-10-13(20)19-15(7-2-3-8-15)11-5-4-6-12(16)9-11/h4-6,9H,2-3,7-8,10H2,1H3,(H,19,20)(H2,17,18,21).
What are the key properties of N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide?
N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide has a molecular weight of 309.80 g/mol, XLogP of 2.15, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide is sourced from PubChem (CID 75393371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).