N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride

C13H25ClN2O2 — CID 120557577

IUPACN-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride
SMILESCC1CNCCC1NC(=O)CCC1CCCO1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-10-9-14-7-6-12(10)15-13(16)5-4-11-3-2-8-17-11;/h10-12,14H,2-9H2,1H3,(H,15,16);1H
InChIKeyUGIOTHWOXHCAQZ-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.48
Rot. Bonds4

About N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride

N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride (PubChem CID 120557577) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride
PubChem CID120557577
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC NameN-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride
SMILESCC1CNCCC1NC(=O)CCC1CCCO1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-10-9-14-7-6-12(10)15-13(16)5-4-11-3-2-8-17-11;/h10-12,14H,2-9H2,1H3,(H,15,16);1H
InChIKeyUGIOTHWOXHCAQZ-UHFFFAOYSA-N
XLogP1.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 120556841
3-(oxan-2-yl)-N-piperidin-4-ylpropanamide;hydrochloride
CID 119386884
N-[(4-methylpiperidin-3-yl)methyl]-3-(oxan-2-yl)propanamide
CID 114955758
3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride
CID 120554749
N-(4-methylcyclohexyl)-3-[(2R)-oxolan-2-yl]propanamide
CID 51728648
N'-(3-methylpiperidin-4-yl)-N-propylbutanediamide;hydrochloride
CID 120557551
N-(3-methylpiperidin-4-yl)decanamide
CID 79886452
N-(2-bromocyclopentyl)-3-(oxolan-2-yl)propanamide
CID 80661636
4-[3-(oxolan-2-yl)propanoylamino]oxolane-3-carboxylic acid
CID 66222668
N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide
CID 114549731
3-(oxolan-2-yl)-N-(1-piperidin-4-ylethyl)propanamide
CID 65154890
N-(2-ethylsulfanylcyclohexyl)-3-(oxolan-2-yl)propanamide
CID 71861380

Frequently Asked Questions

What is the IUPAC name of N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride?
The IUPAC name of N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride (CID 120557577) is N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride.
What is the SMILES notation for N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride?
The canonical SMILES for N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride is CC1CNCCC1NC(=O)CCC1CCCO1.Cl.
What is the InChIKey of N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride?
The InChIKey is UGIOTHWOXHCAQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/c1-10-9-14-7-6-12(10)15-13(16)5-4-11-3-2-8-17-11;/h10-12,14H,2-9H2,1H3,(H,15,16);1H.
What are the key properties of N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride?
N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.48, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride is sourced from PubChem (CID 120557577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).