N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide

C12H24N2O — CID 62338768

IUPACN-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)NCC(C)(C)C
InChIInChI=1S/C12H24N2O/c1-9-6-5-7-13-10(9)11(15)14-8-12(2,3)4/h9-10,13H,5-8H2,1-4H3,(H,14,15)
InChIKeyCARFVFDWSJRSMF-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.54
Rot. Bonds2

About N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide

N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide (PubChem CID 62338768) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide
PubChem CID62338768
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)NCC(C)(C)C
InChIInChI=1S/C12H24N2O/c1-9-6-5-7-13-10(9)11(15)14-8-12(2,3)4/h9-10,13H,5-8H2,1-4H3,(H,14,15)
InChIKeyCARFVFDWSJRSMF-UHFFFAOYSA-N
XLogP1.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide?
The IUPAC name of N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide (CID 62338768) is N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide is CC1CCCNC1C(=O)NCC(C)(C)C.
What is the InChIKey of N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide?
The InChIKey is CARFVFDWSJRSMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9-6-5-7-13-10(9)11(15)14-8-12(2,3)4/h9-10,13H,5-8H2,1-4H3,(H,14,15).
What are the key properties of N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide?
N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide has a molecular weight of 212.34 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-3-methylpiperidine-2-carboxamide is sourced from PubChem (CID 62338768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).