N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide

C17H24N2O2 — CID 95629890

IUPACN-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide
SMILESO=C(C[C@@H]1CCCO1)Nc1cccc(NC2CCCC2)c1
InChIInChI=1S/C17H24N2O2/c20-17(12-16-9-4-10-21-16)19-15-8-3-7-14(11-15)18-13-5-1-2-6-13/h3,7-8,11,13,16,18H,1-2,4-6,9-10,12H2,(H,19,20)/t16-/m0/s1
InChIKeyIVOQDTLTFUPNLT-INIZCTEOSA-N
MW288.39 g/mol
LogP3.55
Rot. Bonds5

About N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide

N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide (PubChem CID 95629890) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide.

Molecular Properties

Compound NameN-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide
PubChem CID95629890
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide
SMILESO=C(C[C@@H]1CCCO1)Nc1cccc(NC2CCCC2)c1
InChIInChI=1S/C17H24N2O2/c20-17(12-16-9-4-10-21-16)19-15-8-3-7-14(11-15)18-13-5-1-2-6-13/h3,7-8,11,13,16,18H,1-2,4-6,9-10,12H2,(H,19,20)/t16-/m0/s1
InChIKeyIVOQDTLTFUPNLT-INIZCTEOSA-N
XLogP3.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-2-(oxolan-2-yl)acetamide
CID 47209133
2-(oxolan-2-yl)-N-[3-(sulfamoylamino)phenyl]acetamide
CID 47211352
N-[3-(hydroxymethyl)phenyl]-2-(oxolan-2-yl)acetamide
CID 65155963
N-(3-methoxyphenyl)-2-(oxan-2-yl)acetamide
CID 110422002
N-[3-(2-aminoethoxy)phenyl]-2-(oxolan-2-yl)acetamide
CID 65152316
N-(3-morpholin-4-ylphenyl)-2-(oxan-2-yl)acetamide
CID 110613011
2-(oxolan-2-yl)-N-[3-[1-(propylamino)ethyl]phenyl]acetamide
CID 65157098
N-(3,5-dimethylphenyl)-2-(oxolan-2-yl)acetamide
CID 47209277
N-(1,3-benzodioxol-5-yl)-2-(oxan-2-yl)acetamide
CID 110426347
N-(4-bromo-3-chlorophenyl)-2-(oxolan-2-yl)acetamide
CID 103824726
N-[3-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]-2-[(2S)-oxolan-2-yl]acetamide
CID 94651264
N-(2,6-dichlorophenyl)-2-(oxolan-2-yl)acetamide
CID 110696672

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide?
The IUPAC name of N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide (CID 95629890) is N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide.
What is the SMILES notation for N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide?
The canonical SMILES for N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide is O=C(C[C@@H]1CCCO1)Nc1cccc(NC2CCCC2)c1.
What is the InChIKey of N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide?
The InChIKey is IVOQDTLTFUPNLT-INIZCTEOSA-N. The full InChI is InChI=1S/C17H24N2O2/c20-17(12-16-9-4-10-21-16)19-15-8-3-7-14(11-15)18-13-5-1-2-6-13/h3,7-8,11,13,16,18H,1-2,4-6,9-10,12H2,(H,19,20)/t16-/m0/s1.
What are the key properties of N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide?
N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide has a molecular weight of 288.39 g/mol, XLogP of 3.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopentylamino)phenyl]-2-[(2S)-oxolan-2-yl]acetamide is sourced from PubChem (CID 95629890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).