N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride

C15H25ClN4O2 — CID 119808460

IUPACN-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride
SMILESCl.Cn1nc(C2CCCCC2)cc1NC(=O)C1COCCN1
InChIInChI=1S/C15H24N4O2.ClH/c1-19-14(17-15(20)13-10-21-8-7-16-13)9-12(18-19)11-5-3-2-4-6-11;/h9,11,13,16H,2-8,10H2,1H3,(H,17,20);1H
InChIKeyULNQHSLNDOETOY-UHFFFAOYSA-N
MW328.84 g/mol
LogP1.82
Rot. Bonds3

About N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride

N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119808460) has the molecular formula C15H25ClN4O2 and a molecular weight of 328.84 g/mol. Its IUPAC name is N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride
PubChem CID119808460
Molecular FormulaC15H25ClN4O2
Molecular Weight328.84 g/mol
Exact Mass328.17
IUPAC NameN-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride
SMILESCl.Cn1nc(C2CCCCC2)cc1NC(=O)C1COCCN1
InChIInChI=1S/C15H24N4O2.ClH/c1-19-14(17-15(20)13-10-21-8-7-16-13)9-12(18-19)11-5-3-2-4-6-11;/h9,11,13,16H,2-8,10H2,1H3,(H,17,20);1H
InChIKeyULNQHSLNDOETOY-UHFFFAOYSA-N
XLogP1.82
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.84
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride (CID 119808460) is N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride is Cl.Cn1nc(C2CCCCC2)cc1NC(=O)C1COCCN1.
What is the InChIKey of N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is ULNQHSLNDOETOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2.ClH/c1-19-14(17-15(20)13-10-21-8-7-16-13)9-12(18-19)11-5-3-2-4-6-11;/h9,11,13,16H,2-8,10H2,1H3,(H,17,20);1H.
What are the key properties of N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride?
N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 328.84 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclohexyl-1-methylpyrazol-5-yl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119808460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).