N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide

C13H24N2O2 — CID 119731741

IUPACN-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide
SMILESO=C(NCC(O)C1CCCCC1)C1CCNC1
InChIInChI=1S/C13H24N2O2/c16-12(10-4-2-1-3-5-10)9-15-13(17)11-6-7-14-8-11/h10-12,14,16H,1-9H2,(H,15,17)
InChIKeyUUMSQQBINXXIHM-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.65
Rot. Bonds4

About N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide

N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide (PubChem CID 119731741) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide
PubChem CID119731741
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide
SMILESO=C(NCC(O)C1CCCCC1)C1CCNC1
InChIInChI=1S/C13H24N2O2/c16-12(10-4-2-1-3-5-10)9-15-13(17)11-6-7-14-8-11/h10-12,14,16H,1-9H2,(H,15,17)
InChIKeyUUMSQQBINXXIHM-UHFFFAOYSA-N
XLogP0.65
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopropyl-2-hydroxyethyl)piperidine-3-carboxamide
CID 63297016
(2S)-2-hydroxy-3-(pyrrolidine-3-carbonylamino)propanoic acid
CID 107835954
N-(3-hydroxy-2-methylpropyl)pyrrolidine-3-carboxamide
CID 65036211
(3S)-N-(2-methylpropyl)pyrrolidine-3-carboxamide;hydrochloride
CID 130617113
N-(3-cyclohexylbutan-2-yl)pyrrolidine-3-carboxamide
CID 119809069
N-[2-(cycloheptylamino)ethyl]pyrrolidine-3-carboxamide
CID 122080782
N-(2,3-dihydroxypropyl)piperidine-3-carboxamide
CID 66169749
N-(3-ethyl-2-hydroxypentyl)pyrrolidine-3-carboxamide
CID 103811158
N-(2-hydroxypentyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119783584
2-hydroxy-3-[[(3R)-piperidine-3-carbonyl]amino]propanoic acid
CID 81134818
N-(2-methoxypropyl)pyrrolidine-3-carboxamide
CID 102694813
N-(2-cyclohexyl-2-hydroxyethyl)-4-hydroxypyrrolidine-2-carboxamide
CID 122145254

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide (CID 119731741) is N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide is O=C(NCC(O)C1CCCCC1)C1CCNC1.
What is the InChIKey of N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide?
The InChIKey is UUMSQQBINXXIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c16-12(10-4-2-1-3-5-10)9-15-13(17)11-6-7-14-8-11/h10-12,14,16H,1-9H2,(H,15,17).
What are the key properties of N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide?
N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.65, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 119731741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).