N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride

C15H25ClN2O2 — CID 119958310

IUPACN-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCC(CC(=O)N(C)Cc1ccco1)C1CCNCC1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-12(13-5-7-16-8-6-13)10-15(18)17(2)11-14-4-3-9-19-14;/h3-4,9,12-13,16H,5-8,10-11H2,1-2H3;1H
InChIKeySQUDTTYTJDVCBV-UHFFFAOYSA-N
MW300.83 g/mol
LogP2.69
Rot. Bonds5

About N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride

N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride (PubChem CID 119958310) has the molecular formula C15H25ClN2O2 and a molecular weight of 300.83 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
PubChem CID119958310
Molecular FormulaC15H25ClN2O2
Molecular Weight300.83 g/mol
Exact Mass300.16
IUPAC NameN-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCC(CC(=O)N(C)Cc1ccco1)C1CCNCC1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-12(13-5-7-16-8-6-13)10-15(18)17(2)11-14-4-3-9-19-14;/h3-4,9,12-13,16H,5-8,10-11H2,1-2H3;1H
InChIKeySQUDTTYTJDVCBV-UHFFFAOYSA-N
XLogP2.69
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.83
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(furan-2-ylmethyl)-N,3-dimethylbutanamide
CID 58845598
5-[furan-2-ylmethyl(methyl)amino]-3-methyl-5-oxopentanoic acid
CID 62966065
N-[(5-bromo-2-fluorophenyl)methyl]-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119764793
N-methyl-3-piperidin-4-yl-N-(1,3-thiazol-2-ylmethyl)butanamide
CID 119891621
N-methyl-3-piperidin-4-yl-N-(1,3-thiazol-4-ylmethyl)butanamide;dihydrochloride
CID 119864913
2-(1,4-diazepan-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide
CID 43162522
4-amino-N-(furan-2-ylmethyl)-N-methylpentanamide;hydrochloride
CID 120566075
N-(furan-2-ylmethyl)-N-methyl-1-piperidin-4-ylmethanamine
CID 16768453
N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-piperidin-4-ylbutanamide
CID 119746206
N-ethyl-3-piperidin-4-yl-N-(thiophen-2-ylmethyl)butanamide;hydrochloride
CID 119690004
N-[2-[benzyl(methyl)amino]-2-oxoethyl]-3-piperidin-4-ylbutanamide
CID 119719399
N-(furan-2-ylmethyl)-N,3-dimethylpiperidine-1-carboxamide
CID 116654269

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride?
The IUPAC name of N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride (CID 119958310) is N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride?
The canonical SMILES for N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride is CC(CC(=O)N(C)Cc1ccco1)C1CCNCC1.Cl.
What is the InChIKey of N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride?
The InChIKey is SQUDTTYTJDVCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.ClH/c1-12(13-5-7-16-8-6-13)10-15(18)17(2)11-14-4-3-9-19-14;/h3-4,9,12-13,16H,5-8,10-11H2,1-2H3;1H.
What are the key properties of N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride?
N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride has a molecular weight of 300.83 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride is sourced from PubChem (CID 119958310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).