2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride

C17H30ClN5O3 — CID 119800873

IUPAC2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride
SMILESCCC(C)C(N)C(=O)Nc1cnn(CC(=O)N2CC(C)OC(C)C2)c1.Cl
InChIInChI=1S/C17H29N5O3.ClH/c1-5-11(2)16(18)17(24)20-14-6-19-22(9-14)10-15(23)21-7-12(3)25-13(4)8-21;/h6,9,11-13,16H,5,7-8,10,18H2,1-4H3,(H,20,24);1H
InChIKeyFWKHNSQBVDPLPK-UHFFFAOYSA-N
MW387.91 g/mol
LogP1.25
Rot. Bonds6

About 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride

2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride (PubChem CID 119800873) has the molecular formula C17H30ClN5O3 and a molecular weight of 387.91 g/mol. Its IUPAC name is 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride
PubChem CID119800873
Molecular FormulaC17H30ClN5O3
Molecular Weight387.91 g/mol
Exact Mass387.20
IUPAC Name2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride
SMILESCCC(C)C(N)C(=O)Nc1cnn(CC(=O)N2CC(C)OC(C)C2)c1.Cl
InChIInChI=1S/C17H29N5O3.ClH/c1-5-11(2)16(18)17(24)20-14-6-19-22(9-14)10-15(23)21-7-12(3)25-13(4)8-21;/h6,9,11-13,16H,5,7-8,10,18H2,1-4H3,(H,20,24);1H
InChIKeyFWKHNSQBVDPLPK-UHFFFAOYSA-N
XLogP1.25
TPSA102.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.91
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride with MolForge

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Related Compounds

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N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride
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N-[1-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]pyrazol-4-yl]-2-methyl-1,3-thiazole-5-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride (CID 119800873) is 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride is CCC(C)C(N)C(=O)Nc1cnn(CC(=O)N2CC(C)OC(C)C2)c1.Cl.
What is the InChIKey of 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride?
The InChIKey is FWKHNSQBVDPLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N5O3.ClH/c1-5-11(2)16(18)17(24)20-14-6-19-22(9-14)10-15(23)21-7-12(3)25-13(4)8-21;/h6,9,11-13,16H,5,7-8,10,18H2,1-4H3,(H,20,24);1H.
What are the key properties of 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride?
2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride has a molecular weight of 387.91 g/mol, XLogP of 1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]pyrazol-4-yl]-3-methylpentanamide;hydrochloride is sourced from PubChem (CID 119800873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).