N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide

C13H24N2O — CID 63142224

IUPACN-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide
SMILESCCC1(C(=O)N(C)CC2CCC2)CCNC1
InChIInChI=1S/C13H24N2O/c1-3-13(7-8-14-10-13)12(16)15(2)9-11-5-4-6-11/h11,14H,3-10H2,1-2H3
InChIKeyFZEMLHWUENAUEK-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.63
Rot. Bonds4

About N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide

N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide (PubChem CID 63142224) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide
PubChem CID63142224
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide
SMILESCCC1(C(=O)N(C)CC2CCC2)CCNC1
InChIInChI=1S/C13H24N2O/c1-3-13(7-8-14-10-13)12(16)15(2)9-11-5-4-6-11/h11,14H,3-10H2,1-2H3
InChIKeyFZEMLHWUENAUEK-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide (CID 63142224) is N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide is CCC1(C(=O)N(C)CC2CCC2)CCNC1.
What is the InChIKey of N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide?
The InChIKey is FZEMLHWUENAUEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-3-13(7-8-14-10-13)12(16)15(2)9-11-5-4-6-11/h11,14H,3-10H2,1-2H3.
What are the key properties of N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide?
N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63142224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).