3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride

C15H28ClN3O3 — CID 120945798

IUPAC3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride
SMILESCl.O=C(CCC1CCCC1)NCC(=O)NCC1CNCC1O
InChIInChI=1S/C15H27N3O3.ClH/c19-13-9-16-7-12(13)8-17-15(21)10-18-14(20)6-5-11-3-1-2-4-11;/h11-13,16,19H,1-10H2,(H,17,21)(H,18,20);1H
InChIKeyUZKHURLZJCLYMA-UHFFFAOYSA-N
MW333.86 g/mol
LogP0.19
Rot. Bonds7

About 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride

3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride (PubChem CID 120945798) has the molecular formula C15H28ClN3O3 and a molecular weight of 333.86 g/mol. Its IUPAC name is 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride.

Molecular Properties

Compound Name3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride
PubChem CID120945798
Molecular FormulaC15H28ClN3O3
Molecular Weight333.86 g/mol
Exact Mass333.18
IUPAC Name3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride
SMILESCl.O=C(CCC1CCCC1)NCC(=O)NCC1CNCC1O
InChIInChI=1S/C15H27N3O3.ClH/c19-13-9-16-7-12(13)8-17-15(21)10-18-14(20)6-5-11-3-1-2-4-11;/h11-13,16,19H,1-10H2,(H,17,21)(H,18,20);1H
InChIKeyUZKHURLZJCLYMA-UHFFFAOYSA-N
XLogP0.19
TPSA90.46 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.86
LogP ≤ 50.19
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-cyclobutyl-N-[(4-hydroxypyrrolidin-3-yl)methyl]propanamide;hydrochloride
CID 120944731
N-[3-[(4-hydroxypyrrolidin-3-yl)methylamino]-3-oxopropyl]cyclohexanecarboxamide
CID 120946529
3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide
CID 119555898
2-cyclopentylsulfonyl-N-[(4-hydroxypyrrolidin-3-yl)methyl]acetamide;hydrochloride
CID 120943963
N-(2-bromoprop-2-enyl)-3-cyclopentylpropanamide
CID 115594621
N-(2-amino-2-oxoethyl)-3-cyclopentylpropanamide
CID 60668206
3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride
CID 120554749
2-[[2-(3-piperidin-4-ylpropanoylamino)acetyl]amino]acetic acid
CID 62210241
3-[[2-(3-cyclopentylpropanoylamino)acetyl]amino]-2,2-dimethylpropanoic acid
CID 119250220
3-cyclopentyl-N-[2-[(2-cyclopentyl-2-hydroxyethyl)amino]-2-oxoethyl]propanamide
CID 111426276
N-[2-[(2-amino-1-cyclopropylethyl)amino]-2-oxoethyl]-3-cyclopentylpropanamide;hydrochloride
CID 119613774
2,2,2-trifluoro-N-[[(3S,4R)-4-hydroxypyrrolidin-3-yl]methyl]acetamide;hydrochloride
CID 87481313

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride?
The IUPAC name of 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride (CID 120945798) is 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride.
What is the SMILES notation for 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride?
The canonical SMILES for 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride is Cl.O=C(CCC1CCCC1)NCC(=O)NCC1CNCC1O.
What is the InChIKey of 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride?
The InChIKey is UZKHURLZJCLYMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O3.ClH/c19-13-9-16-7-12(13)8-17-15(21)10-18-14(20)6-5-11-3-1-2-4-11;/h11-13,16,19H,1-10H2,(H,17,21)(H,18,20);1H.
What are the key properties of 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride?
3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride has a molecular weight of 333.86 g/mol, XLogP of 0.19, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[2-[(4-hydroxypyrrolidin-3-yl)methylamino]-2-oxoethyl]propanamide;hydrochloride is sourced from PubChem (CID 120945798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).