1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine

C15H20N4O — CID 115111993

IUPAC1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine
SMILESCc1ccc(-c2cc(N)n(C)n2)c(N2CCOCC2)c1
InChIInChI=1S/C15H20N4O/c1-11-3-4-12(13-10-15(16)18(2)17-13)14(9-11)19-5-7-20-8-6-19/h3-4,9-10H,5-8,16H2,1-2H3
InChIKeyPKEGIFRXLQRZEP-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.81
Rot. Bonds2

About 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine

1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine (PubChem CID 115111993) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine
PubChem CID115111993
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine
SMILESCc1ccc(-c2cc(N)n(C)n2)c(N2CCOCC2)c1
InChIInChI=1S/C15H20N4O/c1-11-3-4-12(13-10-15(16)18(2)17-13)14(9-11)19-5-7-20-8-6-19/h3-4,9-10H,5-8,16H2,1-2H3
InChIKeyPKEGIFRXLQRZEP-UHFFFAOYSA-N
XLogP1.81
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-2-morpholin-4-ylaniline
CID 18952141
(4-methyl-2-morpholin-4-ylphenyl)methanamine
CID 62308441
4-[2-(furan-2-yl)-4-methylphenyl]morpholine
CID 168526395
N-[(4-methyl-2-morpholin-4-ylphenyl)methyl]hydroxylamine
CID 117111098
3-(4-fluoro-2-morpholin-4-ylphenyl)-1,2-oxazol-5-amine
CID 115112379
4-methyl-2-(1,4-oxazepan-4-yl)benzoic acid
CID 62968020
2-amino-1-(4-methyl-2-morpholin-4-ylphenyl)ethanol
CID 117115348
4-methyl-2-pyrrolidin-1-ylaniline
CID 66998612
3-(2-chloro-6-pyrrolidin-1-ylphenyl)-1-methylpyrazol-5-amine
CID 115111996
4-(4-methyl-2-morpholin-4-ylphenyl)butan-1-amine
CID 117115698
2-amino-1-(4-methyl-2-morpholin-4-ylphenyl)ethanone
CID 117115575
3-(6-fluoro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-methylpyrazol-5-amine
CID 117375477

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine?
The IUPAC name of 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine (CID 115111993) is 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine.
What is the SMILES notation for 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine?
The canonical SMILES for 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine is Cc1ccc(-c2cc(N)n(C)n2)c(N2CCOCC2)c1.
What is the InChIKey of 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine?
The InChIKey is PKEGIFRXLQRZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-11-3-4-12(13-10-15(16)18(2)17-13)14(9-11)19-5-7-20-8-6-19/h3-4,9-10H,5-8,16H2,1-2H3.
What are the key properties of 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine?
1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine has a molecular weight of 272.35 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(4-methyl-2-morpholin-4-ylphenyl)pyrazol-5-amine is sourced from PubChem (CID 115111993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).