N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride

C16H29ClN2O2 — CID 119803923

IUPACN-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)NC2CC2C2CCCCC2)CCNCC1.Cl
InChIInChI=1S/C16H28N2O2.ClH/c1-20-16(7-9-17-10-8-16)15(19)18-14-11-13(14)12-5-3-2-4-6-12;/h12-14,17H,2-11H2,1H3,(H,18,19);1H
InChIKeyWHRVCHICUWDTHZ-UHFFFAOYSA-N
MW316.87 g/mol
LogP2.26
Rot. Bonds4

About N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride

N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride (PubChem CID 119803923) has the molecular formula C16H29ClN2O2 and a molecular weight of 316.87 g/mol. Its IUPAC name is N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
PubChem CID119803923
Molecular FormulaC16H29ClN2O2
Molecular Weight316.87 g/mol
Exact Mass316.19
IUPAC NameN-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)NC2CC2C2CCCCC2)CCNCC1.Cl
InChIInChI=1S/C16H28N2O2.ClH/c1-20-16(7-9-17-10-8-16)15(19)18-14-11-13(14)12-5-3-2-4-6-12;/h12-14,17H,2-11H2,1H3,(H,18,19);1H
InChIKeyWHRVCHICUWDTHZ-UHFFFAOYSA-N
XLogP2.26
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.87
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride (CID 119803923) is N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride is COC1(C(=O)NC2CC2C2CCCCC2)CCNCC1.Cl.
What is the InChIKey of N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride?
The InChIKey is WHRVCHICUWDTHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2.ClH/c1-20-16(7-9-17-10-8-16)15(19)18-14-11-13(14)12-5-3-2-4-6-12;/h12-14,17H,2-11H2,1H3,(H,18,19);1H.
What are the key properties of N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride?
N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride has a molecular weight of 316.87 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylcyclopropyl)-4-methoxypiperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119803923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).