(2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride

C15H31Cl2N3O — CID 119841057

IUPAC(2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride
SMILESCC(C)CN1CCC(NC(=O)[C@H]2CCCCN2)CC1.Cl.Cl
InChIInChI=1S/C15H29N3O.2ClH/c1-12(2)11-18-9-6-13(7-10-18)17-15(19)14-5-3-4-8-16-14;;/h12-14,16H,3-11H2,1-2H3,(H,17,19);2*1H/t14-;;/m1../s1
InChIKeyJNYXLPIHPLXNBD-FMOMHUKBSA-N
MW340.34 g/mol
LogP2.21
Rot. Bonds4

About (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride

(2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride (PubChem CID 119841057) has the molecular formula C15H31Cl2N3O and a molecular weight of 340.34 g/mol. Its IUPAC name is (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound Name(2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride
PubChem CID119841057
Molecular FormulaC15H31Cl2N3O
Molecular Weight340.34 g/mol
Exact Mass339.18
IUPAC Name(2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride
SMILESCC(C)CN1CCC(NC(=O)[C@H]2CCCCN2)CC1.Cl.Cl
InChIInChI=1S/C15H29N3O.2ClH/c1-12(2)11-18-9-6-13(7-10-18)17-15(19)14-5-3-4-8-16-14;;/h12-14,16H,3-11H2,1-2H3,(H,17,19);2*1H/t14-;;/m1../s1
InChIKeyJNYXLPIHPLXNBD-FMOMHUKBSA-N
XLogP2.21
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.34
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-[1-(2-methylpropanoyl)piperidin-4-yl]piperidine-2-carboxamide
CID 103808776
(2R)-N-(1-ethylpiperidin-4-yl)pyrrolidine-2-carboxamide
CID 93469163
N-(1-butylpiperidin-4-yl)azepane-2-carboxamide
CID 64561841
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]azepane-2-carboxamide
CID 64564001
(2R)-N-(1-cyclopentylpiperidin-4-yl)piperidine-2-carboxamide;dihydrochloride
CID 119846635
[4-(2-methylpropyl)piperazin-1-yl]-[(2S)-piperidin-2-yl]methanone
CID 103813273
N-cyclopentylazepane-2-carboxamide
CID 64564743
(2S)-N-(1-prop-2-enylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride
CID 119879117
(2R)-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]pyrrolidine-2-carboxamide
CID 103813420
N-(2-methyl-3-pyrrolidin-1-ylpropyl)piperidine-2-carboxamide;dihydrochloride
CID 119857772
N-(4-ethylcyclohexyl)piperidine-2-carboxamide;hydrochloride
CID 119285364
(2S)-N-cyclopropylpyrrolidine-2-carboxamide;hydrochloride
CID 66855012

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride?
The IUPAC name of (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride (CID 119841057) is (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride.
What is the SMILES notation for (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride?
The canonical SMILES for (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride is CC(C)CN1CCC(NC(=O)[C@H]2CCCCN2)CC1.Cl.Cl.
What is the InChIKey of (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride?
The InChIKey is JNYXLPIHPLXNBD-FMOMHUKBSA-N. The full InChI is InChI=1S/C15H29N3O.2ClH/c1-12(2)11-18-9-6-13(7-10-18)17-15(19)14-5-3-4-8-16-14;;/h12-14,16H,3-11H2,1-2H3,(H,17,19);2*1H/t14-;;/m1../s1.
What are the key properties of (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride?
(2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride has a molecular weight of 340.34 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[1-(2-methylpropyl)piperidin-4-yl]piperidine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119841057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).