N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide

C15H29N3O — CID 3565434

IUPACN-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide
SMILESCCN1CCCC1CNC(C)C(=O)NC1CCCC1
InChIInChI=1S/C15H29N3O/c1-3-18-10-6-9-14(18)11-16-12(2)15(19)17-13-7-4-5-8-13/h12-14,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyZWGSMRCMUMXBCS-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.51
Rot. Bonds6

About N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide

N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide (PubChem CID 3565434) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide
PubChem CID3565434
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide
SMILESCCN1CCCC1CNC(C)C(=O)NC1CCCC1
InChIInChI=1S/C15H29N3O/c1-3-18-10-6-9-14(18)11-16-12(2)15(19)17-13-7-4-5-8-13/h12-14,16H,3-11H2,1-2H3,(H,17,19)
InChIKeyZWGSMRCMUMXBCS-UHFFFAOYSA-N
XLogP1.51
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide?
The IUPAC name of N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide (CID 3565434) is N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide.
What is the SMILES notation for N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide?
The canonical SMILES for N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide is CCN1CCCC1CNC(C)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide?
The InChIKey is ZWGSMRCMUMXBCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-3-18-10-6-9-14(18)11-16-12(2)15(19)17-13-7-4-5-8-13/h12-14,16H,3-11H2,1-2H3,(H,17,19).
What are the key properties of N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide?
N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide has a molecular weight of 267.42 g/mol, XLogP of 1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(1-ethylpyrrolidin-2-yl)methylamino]propanamide is sourced from PubChem (CID 3565434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).