N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide

C22H26N2O2S — CID 3202881

IUPACN-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide
SMILESO=C(NC1CCCC1)C(c1ccccc1)N(C(=O)Cc1cccs1)C1CC1
InChIInChI=1S/C22H26N2O2S/c25-20(15-19-11-6-14-27-19)24(18-12-13-18)21(16-7-2-1-3-8-16)22(26)23-17-9-4-5-10-17/h1-3,6-8,11,14,17-18,21H,4-5,9-10,12-13,15H2,(H,23,26)
InChIKeyKTZNWEXPSJGZBC-UHFFFAOYSA-N
MW382.53 g/mol
LogP4.08
Rot. Bonds7

About N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide

N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide (PubChem CID 3202881) has the molecular formula C22H26N2O2S and a molecular weight of 382.53 g/mol. Its IUPAC name is N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide
PubChem CID3202881
Molecular FormulaC22H26N2O2S
Molecular Weight382.53 g/mol
Exact Mass382.17
IUPAC NameN-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide
SMILESO=C(NC1CCCC1)C(c1ccccc1)N(C(=O)Cc1cccs1)C1CC1
InChIInChI=1S/C22H26N2O2S/c25-20(15-19-11-6-14-27-19)24(18-12-13-18)21(16-7-2-1-3-8-16)22(26)23-17-9-4-5-10-17/h1-3,6-8,11,14,17-18,21H,4-5,9-10,12-13,15H2,(H,23,26)
InChIKeyKTZNWEXPSJGZBC-UHFFFAOYSA-N
XLogP4.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.53
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-(4-propan-2-ylphenyl)acetamide
CID 7383213
methyl 4-[(1R)-2-(cyclohexylamino)-1-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-oxoethyl]benzoate
CID 40836489
N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-(3-methoxyphenyl)acetamide
CID 3202678
N-cyclohexyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-(3-methylthiophen-2-yl)acetamide
CID 652619
N-cyclopentyl-2-(2,6-dimethyl-N-(2-thiophen-2-ylacetyl)anilino)-2-phenylacetamide
CID 3202956
N-cyclopentyl-2-pyridin-4-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide
CID 3202613
2-[benzyl-(2-thiophen-2-ylacetyl)amino]-N-cyclohexyl-2-pyridin-4-ylacetamide
CID 3191114
(2R)-N-cyclohexyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-(2,4-dimethoxyphenyl)acetamide
CID 25310056
N-cyclopentyl-2-(3,4-dimethoxy-N-(2-thiophen-2-ylacetyl)anilino)-2-phenylacetamide
CID 3202943
N-cyclopentyl-2-[(3-methoxyphenyl)methyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide
CID 3202922
N-cyclohexyl-2-[(2-fluorocyclohexa-1,5-dien-1-yl)-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide
CID 163543998
(2R)-2-(4-chlorophenyl)-N-cyclohexyl-2-[(2-thiophen-2-ylacetyl)-(thiophen-2-ylmethyl)amino]acetamide
CID 1441603

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide?
The IUPAC name of N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide (CID 3202881) is N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide.
What is the SMILES notation for N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide?
The canonical SMILES for N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide is O=C(NC1CCCC1)C(c1ccccc1)N(C(=O)Cc1cccs1)C1CC1.
What is the InChIKey of N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide?
The InChIKey is KTZNWEXPSJGZBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2S/c25-20(15-19-11-6-14-27-19)24(18-12-13-18)21(16-7-2-1-3-8-16)22(26)23-17-9-4-5-10-17/h1-3,6-8,11,14,17-18,21H,4-5,9-10,12-13,15H2,(H,23,26).
What are the key properties of N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide?
N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide has a molecular weight of 382.53 g/mol, XLogP of 4.08, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[cyclopropyl-(2-thiophen-2-ylacetyl)amino]-2-phenylacetamide is sourced from PubChem (CID 3202881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).