N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride

C13H25ClN2O2 — CID 119785421

IUPACN-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)NCC2CC2(C)C)CCNCC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-12(2)8-10(12)9-15-11(16)13(17-3)4-6-14-7-5-13;/h10,14H,4-9H2,1-3H3,(H,15,16);1H
InChIKeyVOWSFVNDBZTWJQ-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.34
Rot. Bonds4

About N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride

N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride (PubChem CID 119785421) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
PubChem CID119785421
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC NameN-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)NCC2CC2(C)C)CCNCC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-12(2)8-10(12)9-15-11(16)13(17-3)4-6-14-7-5-13;/h10,14H,4-9H2,1-3H3,(H,15,16);1H
InChIKeyVOWSFVNDBZTWJQ-UHFFFAOYSA-N
XLogP1.34
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-(thian-4-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 119756569
4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide
CID 119750242
4-methoxy-N-(2-methylpropyl)piperidine-4-carboxamide
CID 119673792
N-[(2,2-dimethylcyclopropyl)methyl]-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119945451
4-methoxy-N-pentylpiperidine-4-carboxamide
CID 119669674
4-methoxy-N-(4-methylpentyl)piperidine-4-carboxamide;hydrochloride
CID 119718677
ethyl 2-[(4-methoxypiperidine-4-carbonyl)amino]acetate
CID 119706107
4-methoxy-N-[2-(oxan-4-yl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 119724834
N-[(2,2-dimethylcyclopropyl)methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120932686
N-(2-hydroxypentyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119783577
N-[(2,2-dimethylcyclopropyl)methyl]-2-methylpyrrolidine-2-carboxamide
CID 103822228
N-(3-amino-2-hydroxy-3-oxopropyl)-4-methoxypiperidine-4-carboxamide
CID 114284552

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride (CID 119785421) is N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride is COC1(C(=O)NCC2CC2(C)C)CCNCC1.Cl.
What is the InChIKey of N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride?
The InChIKey is VOWSFVNDBZTWJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/c1-12(2)8-10(12)9-15-11(16)13(17-3)4-6-14-7-5-13;/h10,14H,4-9H2,1-3H3,(H,15,16);1H.
What are the key properties of N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride?
N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119785421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).