3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide

C13H24N2O2 — CID 55166675

IUPAC3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NC2CCCC(O)C2)CCNC1
InChIInChI=1S/C13H24N2O2/c1-2-13(6-7-14-9-13)12(17)15-10-4-3-5-11(16)8-10/h10-11,14,16H,2-9H2,1H3,(H,15,17)
InChIKeyRTUSASJTCXOXRM-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.80
Rot. Bonds3

About 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide

3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide (PubChem CID 55166675) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide
PubChem CID55166675
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NC2CCCC(O)C2)CCNC1
InChIInChI=1S/C13H24N2O2/c1-2-13(6-7-14-9-13)12(17)15-10-4-3-5-11(16)8-10/h10-11,14,16H,2-9H2,1H3,(H,15,17)
InChIKeyRTUSASJTCXOXRM-UHFFFAOYSA-N
XLogP0.80
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide
CID 63141088
N-cyclobutyl-3-propylpyrrolidine-3-carboxamide
CID 63142561
3-ethyl-N-(oxan-3-yl)pyrrolidine-3-carboxamide
CID 63361296
N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide
CID 55179480
3-ethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrrolidine-3-carboxamide
CID 63139525
N-cyclooctyl-4-ethylpiperidine-4-carboxamide
CID 63127199
N-cyclopentyl-3-propylpyrrolidine-3-carboxamide
CID 63141137
1-(aminomethyl)-N-(3-hydroxycyclohexyl)cycloheptane-1-carboxamide
CID 115443799
N-cyclobutyl-1-ethylcyclopropane-1-carboxamide
CID 130693550
3-ethyl-N-(1-methylpiperidin-3-yl)piperidine-3-carboxamide
CID 63135196
N-[(1R)-1-cycloheptylethyl]-3-ethylpyrrolidine-3-carboxamide
CID 81391921
3-ethyl-N-[(2-hydroxycyclohexyl)methyl]pyrrolidine-3-carboxamide
CID 64913056

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide (CID 55166675) is 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide is CCC1(C(=O)NC2CCCC(O)C2)CCNC1.
What is the InChIKey of 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide?
The InChIKey is RTUSASJTCXOXRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-2-13(6-7-14-9-13)12(17)15-10-4-3-5-11(16)8-10/h10-11,14,16H,2-9H2,1H3,(H,15,17).
What are the key properties of 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide?
3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.80, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(3-hydroxycyclohexyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 55166675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).