N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride

C14H29ClN2O — CID 119672315

IUPACN-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride
SMILESCCCCN(C)C(=O)CC(C)C1CCCNC1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-4-5-9-16(3)14(17)10-12(2)13-7-6-8-15-11-13;/h12-13,15H,4-11H2,1-3H3;1H
InChIKeyDHXQTURZHOVOBI-UHFFFAOYSA-N
MW276.85 g/mol
LogP2.69
Rot. Bonds6

About N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride

N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride (PubChem CID 119672315) has the molecular formula C14H29ClN2O and a molecular weight of 276.85 g/mol. Its IUPAC name is N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride.

Molecular Properties

Compound NameN-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride
PubChem CID119672315
Molecular FormulaC14H29ClN2O
Molecular Weight276.85 g/mol
Exact Mass276.20
IUPAC NameN-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride
SMILESCCCCN(C)C(=O)CC(C)C1CCCNC1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-4-5-9-16(3)14(17)10-12(2)13-7-6-8-15-11-13;/h12-13,15H,4-11H2,1-3H3;1H
InChIKeyDHXQTURZHOVOBI-UHFFFAOYSA-N
XLogP2.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.85
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-3-piperidin-3-yl-N-propylbutanamide
CID 81043827
N-butan-2-yl-N-butyl-3-piperidin-3-ylbutanamide
CID 81043746
N-butyl-N-methyl-1-(3-piperidin-3-ylbutanoyl)piperidine-4-carboxamide;hydrochloride
CID 119738391
N-methyl-N-[2-(methylamino)ethyl]-3-piperidin-3-ylbutanamide
CID 81043953
3-piperidin-3-yl-N,N-dipropylbutanamide
CID 81043811
N-methyl-N-(2-methylpropyl)-3-piperidin-3-ylbutanamide
CID 81043828
N-methyl-N-(3-phenoxypropyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119731938
3-piperidin-3-yl-N-propan-2-yl-N-propylbutanamide
CID 81043730
N-(2,2-difluoroethyl)-N-methyl-3-piperidin-3-ylbutanamide
CID 115738604
N-(2-amino-2-oxoethyl)-N-methyl-3-piperidin-3-ylbutanamide
CID 81044730
N-[3-(3,5-dimethoxyphenoxy)propyl]-N-methyl-3-piperidin-3-ylbutanamide
CID 119820817
N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119818677

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride?
The IUPAC name of N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride (CID 119672315) is N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride.
What is the SMILES notation for N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride?
The canonical SMILES for N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride is CCCCN(C)C(=O)CC(C)C1CCCNC1.Cl.
What is the InChIKey of N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride?
The InChIKey is DHXQTURZHOVOBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O.ClH/c1-4-5-9-16(3)14(17)10-12(2)13-7-6-8-15-11-13;/h12-13,15H,4-11H2,1-3H3;1H.
What are the key properties of N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride?
N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride has a molecular weight of 276.85 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride is sourced from PubChem (CID 119672315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).