N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide

C16H30N2O — CID 106980796

IUPACN-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide
SMILESCCC1CCCC(NC(=O)C2(C(C)C)CCNC2)C1
InChIInChI=1S/C16H30N2O/c1-4-13-6-5-7-14(10-13)18-15(19)16(12(2)3)8-9-17-11-16/h12-14,17H,4-11H2,1-3H3,(H,18,19)
InChIKeyQHCZCRCTFAKOAB-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.71
Rot. Bonds4

About N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide

N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide (PubChem CID 106980796) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide
PubChem CID106980796
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide
SMILESCCC1CCCC(NC(=O)C2(C(C)C)CCNC2)C1
InChIInChI=1S/C16H30N2O/c1-4-13-6-5-7-14(10-13)18-15(19)16(12(2)3)8-9-17-11-16/h12-14,17H,4-11H2,1-3H3,(H,18,19)
InChIKeyQHCZCRCTFAKOAB-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-methylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106981352
N-(oxan-3-yl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980679
N-[2-(hydroxymethyl)cyclopentyl]-3-propan-2-ylpyrrolidine-3-carboxamide
CID 114178691
N-(4-carbamoylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106979816
3-propan-2-yl-N-(1-propan-2-ylpiperidin-4-yl)pyrrolidine-3-carboxamide
CID 106979930
1-cyano-N-(3-ethylcyclohexyl)cyclopentane-1-carboxamide
CID 64749617
1-cyano-N-(3-ethylcyclohexyl)cyclohexane-1-carboxamide
CID 64749228
N-(3-ethylcyclohexyl)-2-piperazin-1-ylpropanamide
CID 64743330
2-cyclohexyl-1-(3-propan-2-ylpyrrolidin-3-yl)ethanone
CID 106982112
N-ethylsulfonyl-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106981399
cyclobutyl-(3-propan-2-ylpyrrolidin-3-yl)methanone
CID 106982353
3-propan-2-ylpyrrolidine-3-carbohydrazide
CID 106980734

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
The IUPAC name of N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide (CID 106980796) is N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide is CCC1CCCC(NC(=O)C2(C(C)C)CCNC2)C1.
What is the InChIKey of N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
The InChIKey is QHCZCRCTFAKOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-4-13-6-5-7-14(10-13)18-15(19)16(12(2)3)8-9-17-11-16/h12-14,17H,4-11H2,1-3H3,(H,18,19).
What are the key properties of N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide?
N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylcyclohexyl)-3-propan-2-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 106980796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).