2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride

C12H23ClN2O — CID 120599635

IUPAC2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride
SMILESCC1CC(NC(=O)C2CC2(C)C)CCN1.Cl
InChIInChI=1S/C12H22N2O.ClH/c1-8-6-9(4-5-13-8)14-11(15)10-7-12(10,2)3;/h8-10,13H,4-7H2,1-3H3,(H,14,15);1H
InChIKeyKNLXXKSENOSQNF-UHFFFAOYSA-N
MW246.78 g/mol
LogP1.71
Rot. Bonds2

About 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride

2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride (PubChem CID 120599635) has the molecular formula C12H23ClN2O and a molecular weight of 246.78 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride
PubChem CID120599635
Molecular FormulaC12H23ClN2O
Molecular Weight246.78 g/mol
Exact Mass246.15
IUPAC Name2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride
SMILESCC1CC(NC(=O)C2CC2(C)C)CCN1.Cl
InChIInChI=1S/C12H22N2O.ClH/c1-8-6-9(4-5-13-8)14-11(15)10-7-12(10,2)3;/h8-10,13H,4-7H2,1-3H3,(H,14,15);1H
InChIKeyKNLXXKSENOSQNF-UHFFFAOYSA-N
XLogP1.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.78
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-N-pyrrolidin-3-ylcyclopropane-1-carboxamide
CID 119030831
N-cyclopropyl-2,2-dimethylcyclopropane-1-carboxamide
CID 103837193
4,4-difluoro-N-(2-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 106995432
[(2R,4R)-2-methylpiperidin-4-yl]carbamic acid
CID 146485805
4-methyl-N-(2-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 106995297
3,5-dimethyl-N-(2-methylpiperidin-4-yl)adamantane-1-carboxamide;hydrochloride
CID 120601324
N-cyclopentyl-2,2-dimethylcyclopropane-1-carboxamide
CID 103837196
N-(2-methylpiperidin-4-yl)thiane-2-carboxamide
CID 106995179
N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride
CID 120598192
2,2-dimethyl-N-[4-(methylamino)cyclohexyl]cyclopropane-1-carboxamide
CID 107000570
4-tert-butyl-N-(2-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 106995414
2-methyl-N-(2-methylpiperidin-4-yl)oxolane-3-carboxamide
CID 106995532

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride (CID 120599635) is 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride is CC1CC(NC(=O)C2CC2(C)C)CCN1.Cl.
What is the InChIKey of 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride?
The InChIKey is KNLXXKSENOSQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O.ClH/c1-8-6-9(4-5-13-8)14-11(15)10-7-12(10,2)3;/h8-10,13H,4-7H2,1-3H3,(H,14,15);1H.
What are the key properties of 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride?
2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride has a molecular weight of 246.78 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 120599635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).