3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride

C16H30ClN3O2 — CID 120554749

IUPAC3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride
SMILESCC1CNCCC1NC(=O)CNC(=O)CCC1CCCC1.Cl
InChIInChI=1S/C16H29N3O2.ClH/c1-12-10-17-9-8-14(12)19-16(21)11-18-15(20)7-6-13-4-2-3-5-13;/h12-14,17H,2-11H2,1H3,(H,18,20)(H,19,21);1H
InChIKeyQWLUVVDMPUULRT-UHFFFAOYSA-N
MW331.89 g/mol
LogP1.61
Rot. Bonds6

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

3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride (PubChem CID 120554749) has the molecular formula C16H30ClN3O2 and a molecular weight of 331.89 g/mol. Its IUPAC name is 3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride.

Molecular Properties

Compound Name3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride
PubChem CID120554749
Molecular FormulaC16H30ClN3O2
Molecular Weight331.89 g/mol
Exact Mass331.20
IUPAC Name3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride
SMILESCC1CNCCC1NC(=O)CNC(=O)CCC1CCCC1.Cl
InChIInChI=1S/C16H29N3O2.ClH/c1-12-10-17-9-8-14(12)19-16(21)11-18-15(20)7-6-13-4-2-3-5-13;/h12-14,17H,2-11H2,1H3,(H,18,20)(H,19,21);1H
InChIKeyQWLUVVDMPUULRT-UHFFFAOYSA-N
XLogP1.61
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.89
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride
CID 120554584
N-(2-methylcyclohexyl)-3-piperidin-4-ylpropanamide
CID 62210845
N'-(3-methylpiperidin-4-yl)-N-propylbutanediamide;hydrochloride
CID 120557551
N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride
CID 120557577
3-cyclopentyl-N-[2-[methyl(pyrrolidin-3-yl)amino]-2-oxoethyl]propanamide
CID 119550902
4-[(2-cyclopentylacetyl)amino]-N-(3-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 120555118
3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide
CID 119555898
N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride
CID 120557474
N-[2-(cyclopropylamino)-2-oxoethyl]-3-piperidin-4-ylpropanamide
CID 55049712
N'-(3-methylpiperidin-4-yl)-N-propylpentanediamide
CID 120554463
2-(diethylamino)-N-(3-methylpiperidin-4-yl)acetamide;dihydrochloride
CID 120553416
N-(3-methylpiperidin-4-yl)decanamide
CID 79886452

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride?
The IUPAC name of 3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride (CID 120554749) is 3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride.
What is the SMILES notation for 3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride?
The canonical SMILES for 3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride is CC1CNCCC1NC(=O)CNC(=O)CCC1CCCC1.Cl.
What is the InChIKey of 3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride?
The InChIKey is QWLUVVDMPUULRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O2.ClH/c1-12-10-17-9-8-14(12)19-16(21)11-18-15(20)7-6-13-4-2-3-5-13;/h12-14,17H,2-11H2,1H3,(H,18,20)(H,19,21);1H.
What are the key properties of 3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride?
3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride has a molecular weight of 331.89 g/mol, XLogP of 1.61, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride is sourced from PubChem (CID 120554749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).