N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide

C15H27NO2 — CID 100701569

IUPACN-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide
SMILESO=C(NC[C@@H](CO)CC1CCCC1)C1CCCC1
InChIInChI=1S/C15H27NO2/c17-11-13(9-12-5-1-2-6-12)10-16-15(18)14-7-3-4-8-14/h12-14,17H,1-11H2,(H,16,18)/t13-/m0/s1
InChIKeyUMJUCTHRKRTBLI-ZDUSSCGKSA-N
MW253.39 g/mol
LogP2.48
Rot. Bonds6

About N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide

N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide (PubChem CID 100701569) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide
PubChem CID100701569
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC NameN-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide
SMILESO=C(NC[C@@H](CO)CC1CCCC1)C1CCCC1
InChIInChI=1S/C15H27NO2/c17-11-13(9-12-5-1-2-6-12)10-16-15(18)14-7-3-4-8-14/h12-14,17H,1-11H2,(H,16,18)/t13-/m0/s1
InChIKeyUMJUCTHRKRTBLI-ZDUSSCGKSA-N
XLogP2.48
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-2,3-dihydroxypropyl]cyclobutanecarboxamide
CID 165487313
N-[(2S)-2-[(2-bromophenyl)methyl]-3-hydroxypropyl]cyclohexanecarboxamide
CID 100634985
N-(2-chloropropyl)cyclopentanecarboxamide
CID 114296250
N-(2-methylpropyl)cyclooctanecarboxamide
CID 65022959
N-[(2R)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopropanesulfonamide
CID 100688312
N-[(2S)-2-(cyclohexylmethyl)-3-hydroxypropyl]-6-methylpyridine-3-carboxamide
CID 124844251
CID 59070118
CID 59070118
N-(2-cyclopentylethyl)cyclopentanecarboxamide
CID 110874283
N-[2-(2-aminoethyl)pentyl]cyclopentanecarboxamide
CID 106116208
N-[[4-[(cyclopentanecarbonylamino)methyl]cyclohexyl]methyl]cyclopentanecarboxamide
CID 125471839
N-[(2R)-2-(cyclohexylmethyl)-3-hydroxypropyl]-5-fluoropyridine-3-carboxamide
CID 124844495
N-(2-cycloundecyl-2-nitroethyl)cyclodecanecarboxamide
CID 134350874

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide?
The IUPAC name of N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide (CID 100701569) is N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide?
The canonical SMILES for N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide is O=C(NC[C@@H](CO)CC1CCCC1)C1CCCC1.
What is the InChIKey of N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide?
The InChIKey is UMJUCTHRKRTBLI-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H27NO2/c17-11-13(9-12-5-1-2-6-12)10-16-15(18)14-7-3-4-8-14/h12-14,17H,1-11H2,(H,16,18)/t13-/m0/s1.
What are the key properties of N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide?
N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide has a molecular weight of 253.39 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-(cyclopentylmethyl)-3-hydroxypropyl]cyclopentanecarboxamide is sourced from PubChem (CID 100701569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).