N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide

C14H28N2O — CID 63833754

IUPACN-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide
SMILESCCN(C(=O)CC(C)C(C)(C)C)C1CCNC1
InChIInChI=1S/C14H28N2O/c1-6-16(12-7-8-15-10-12)13(17)9-11(2)14(3,4)5/h11-12,15H,6-10H2,1-5H3
InChIKeyDBBMBUAVTSLYCG-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.27
Rot. Bonds4

About N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide

N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide (PubChem CID 63833754) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide.

Molecular Properties

Compound NameN-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide
PubChem CID63833754
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide
SMILESCCN(C(=O)CC(C)C(C)(C)C)C1CCNC1
InChIInChI=1S/C14H28N2O/c1-6-16(12-7-8-15-10-12)13(17)9-11(2)14(3,4)5/h11-12,15H,6-10H2,1-5H3
InChIKeyDBBMBUAVTSLYCG-UHFFFAOYSA-N
XLogP2.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-oxoethyl)-3,4,4-trimethyl-N-piperidin-4-ylpentanamide
CID 63834715
N-ethyl-3-methyl-N-piperidin-4-ylbutanamide
CID 60806063
3,4-dimethyl-N-propyl-N-pyrrolidin-3-ylpentanamide
CID 119533162
N,3,4,4-tetramethyl-N-piperidin-3-ylpentanamide
CID 63833926
3-chloro-N-ethyl-N-pyrrolidin-3-ylpropanamide
CID 165439782
N,2-diethyl-N-pyrrolidin-3-ylbutanamide
CID 60805502
N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide
CID 106629403
N-cyclopropyl-N-ethyl-3-piperidin-4-ylbutanamide
CID 119718930
3-ethyl-4-methyl-N-propyl-N-pyrrolidin-3-ylpentanamide;hydrochloride
CID 119530049
ethyl N-ethyl-N-pyrrolidin-3-ylcarbamate
CID 60805526
2-cyclohexyl-N-ethyl-N-pyrrolidin-3-ylacetamide
CID 60807538
4-[ethyl(piperidin-4-yl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 65299800

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide?
The IUPAC name of N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide (CID 63833754) is N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide.
What is the SMILES notation for N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide?
The canonical SMILES for N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide is CCN(C(=O)CC(C)C(C)(C)C)C1CCNC1.
What is the InChIKey of N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide?
The InChIKey is DBBMBUAVTSLYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-6-16(12-7-8-15-10-12)13(17)9-11(2)14(3,4)5/h11-12,15H,6-10H2,1-5H3.
What are the key properties of N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide?
N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide has a molecular weight of 240.39 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide is sourced from PubChem (CID 63833754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).