2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride

C13H26ClN3O — CID 119915633

IUPAC2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride
SMILESCl.NCC1CCCN(CC(=O)NC2CCCC2)C1
InChIInChI=1S/C13H25N3O.ClH/c14-8-11-4-3-7-16(9-11)10-13(17)15-12-5-1-2-6-12;/h11-12H,1-10,14H2,(H,15,17);1H
InChIKeyRPIVUTDVXDZIJO-UHFFFAOYSA-N
MW275.82 g/mol
LogP1.14
Rot. Bonds4

About 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride

2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride (PubChem CID 119915633) has the molecular formula C13H26ClN3O and a molecular weight of 275.82 g/mol. Its IUPAC name is 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride.

Molecular Properties

Compound Name2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride
PubChem CID119915633
Molecular FormulaC13H26ClN3O
Molecular Weight275.82 g/mol
Exact Mass275.18
IUPAC Name2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride
SMILESCl.NCC1CCCN(CC(=O)NC2CCCC2)C1
InChIInChI=1S/C13H25N3O.ClH/c14-8-11-4-3-7-16(9-11)10-13(17)15-12-5-1-2-6-12;/h11-12H,1-10,14H2,(H,15,17);1H
InChIKeyRPIVUTDVXDZIJO-UHFFFAOYSA-N
XLogP1.14
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.82
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclooctyl-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119918786
2-[3-(aminomethyl)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
CID 119915605
N-cyclohexyl-2-[(3S)-3-hydroxypiperidin-1-yl]acetamide
CID 107225773
2-[3-(aminomethyl)piperidin-1-yl]-N-tert-butylacetamide
CID 43186946
2-[3-(aminomethyl)piperidin-1-yl]-N-(2-methylpropyl)acetamide;hydrochloride
CID 119915902
2-[3-(1-aminoethyl)piperidin-1-yl]-N-cycloheptylacetamide;hydrochloride
CID 119925682
2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide
CID 63760720
N-(2-aminoethyl)-1-[2-(cyclopentylamino)-2-oxoethyl]piperidine-3-carboxamide
CID 63252704
2-(3-acetylpiperidin-1-yl)-N-cyclohexylacetamide
CID 55256614
N-[1-[2-(cyclopentylamino)-2-oxoethyl]piperidin-3-yl]cyclobutanecarboxamide
CID 171335040
N-cyclopentyl-2-[(3R)-3-hydroxypyrrolidin-1-yl]acetamide
CID 78962574
2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide
CID 62548940

Frequently Asked Questions

What is the IUPAC name of 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride?
The IUPAC name of 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride (CID 119915633) is 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride.
What is the SMILES notation for 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride?
The canonical SMILES for 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride is Cl.NCC1CCCN(CC(=O)NC2CCCC2)C1.
What is the InChIKey of 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride?
The InChIKey is RPIVUTDVXDZIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O.ClH/c14-8-11-4-3-7-16(9-11)10-13(17)15-12-5-1-2-6-12;/h11-12H,1-10,14H2,(H,15,17);1H.
What are the key properties of 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride?
2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride has a molecular weight of 275.82 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride is sourced from PubChem (CID 119915633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).