N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide

C16H31N3O — CID 63853758

IUPACN-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
SMILESCNC(C)C1CCCN(C(C)C(=O)NC2CCCC2)C1
InChIInChI=1S/C16H31N3O/c1-12(17-3)14-7-6-10-19(11-14)13(2)16(20)18-15-8-4-5-9-15/h12-15,17H,4-11H2,1-3H3,(H,18,20)
InChIKeyKDOFYTNZCAQCMY-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.75
Rot. Bonds5

About N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide

N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide (PubChem CID 63853758) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
PubChem CID63853758
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
SMILESCNC(C)C1CCCN(C(C)C(=O)NC2CCCC2)C1
InChIInChI=1S/C16H31N3O/c1-12(17-3)14-7-6-10-19(11-14)13(2)16(20)18-15-8-4-5-9-15/h12-15,17H,4-11H2,1-3H3,(H,18,20)
InChIKeyKDOFYTNZCAQCMY-UHFFFAOYSA-N
XLogP1.75
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
CID 55258571
1-(azepan-1-yl)-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propan-1-one
CID 63854094
(3S)-1-[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl]piperidine-3-carboxamide
CID 8543236
N-cyclopentyl-2-[3-(ethylaminomethyl)piperidin-1-yl]propanamide
CID 63849664
2-[3-(2-aminoethyl)piperidin-1-yl]-N-cyclopentylpropanamide
CID 63764074
N-cyclopentyl-2-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]propanamide
CID 79411085
N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide
CID 61204430
N-(furan-2-ylmethyl)-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
CID 63853927
N-cyclopentyl-2-(3-methylpiperazin-1-yl)propanamide
CID 65447521
N-cyclopentyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]propanamide;hydrochloride
CID 119922095
2-(4-acetylpiperazin-1-yl)-N-cyclopentylpropanamide
CID 123939055
N-cyclopentyl-2-(1,4-diazepan-1-yl)propanamide
CID 43115745

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide?
The IUPAC name of N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide (CID 63853758) is N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide.
What is the SMILES notation for N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide?
The canonical SMILES for N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide is CNC(C)C1CCCN(C(C)C(=O)NC2CCCC2)C1.
What is the InChIKey of N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide?
The InChIKey is KDOFYTNZCAQCMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-12(17-3)14-7-6-10-19(11-14)13(2)16(20)18-15-8-4-5-9-15/h12-15,17H,4-11H2,1-3H3,(H,18,20).
What are the key properties of N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide?
N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide has a molecular weight of 281.44 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide is sourced from PubChem (CID 63853758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).