N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide

C14H26N2O — CID 63143362

IUPACN-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide
SMILESCCCCN(C(=O)C1(CC)CCNC1)C1CC1
InChIInChI=1S/C14H26N2O/c1-3-5-10-16(12-6-7-12)13(17)14(4-2)8-9-15-11-14/h12,15H,3-11H2,1-2H3
InChIKeyQTKLWDDUOIJVBI-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.17
Rot. Bonds6

About N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide

N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide (PubChem CID 63143362) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide
PubChem CID63143362
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide
SMILESCCCCN(C(=O)C1(CC)CCNC1)C1CC1
InChIInChI=1S/C14H26N2O/c1-3-5-10-16(12-6-7-12)13(17)14(4-2)8-9-15-11-14/h12,15H,3-11H2,1-2H3
InChIKeyQTKLWDDUOIJVBI-UHFFFAOYSA-N
XLogP2.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-N-cyclopropyl-3-ethylpiperidine-3-carboxamide
CID 63131459
3-[cyclopropyl-(3-ethylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 63141640
N-cyclopropyl-N,4-diethylpiperidine-4-carboxamide
CID 63127607
N-butyl-3-ethyl-N-(2-hydroxyethyl)pyrrolidine-3-carboxamide
CID 63143750
3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid
CID 63128710
2-[cyclopentyl-(3-ethylpyrrolidine-3-carbonyl)amino]acetic acid
CID 63141424
N-benzyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide
CID 63138591
N-cyclopropyl-4-ethyl-N-(2-methoxyethyl)piperidine-4-carboxamide
CID 63128216
N-(1,1-dioxothiolan-3-yl)-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
CID 63139877
N-cyclobutyl-N-(3-hydroxypropyl)-4-propylpiperidine-4-carboxamide
CID 102861592
3-ethyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylpyrrolidine-3-carboxamide
CID 114948885
4-ethyl-N-methyl-N-(4-methylcyclohexyl)piperidine-4-carboxamide
CID 63128518

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide?
The IUPAC name of N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide (CID 63143362) is N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide?
The canonical SMILES for N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide is CCCCN(C(=O)C1(CC)CCNC1)C1CC1.
What is the InChIKey of N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide?
The InChIKey is QTKLWDDUOIJVBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-5-10-16(12-6-7-12)13(17)14(4-2)8-9-15-11-14/h12,15H,3-11H2,1-2H3.
What are the key properties of N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide?
N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63143362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).