2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine

C17H18N6O — CID 29182338

IUPAC2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine
SMILESNc1cc(-c2cccc(-c3ccn[nH]3)c2)nc(N2CCOCC2)n1
InChIInChI=1S/C17H18N6O/c18-16-11-15(20-17(21-16)23-6-8-24-9-7-23)13-3-1-2-12(10-13)14-4-5-19-22-14/h1-5,10-11H,6-9H2,(H,19,22)(H2,18,20,21)
InChIKeyUODUEZCYYQQGPI-UHFFFAOYSA-N
MW322.37 g/mol
LogP1.95
Rot. Bonds3

About 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine

2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine (PubChem CID 29182338) has the molecular formula C17H18N6O and a molecular weight of 322.37 g/mol. Its IUPAC name is 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine.

Molecular Properties

Compound Name2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine
PubChem CID29182338
Molecular FormulaC17H18N6O
Molecular Weight322.37 g/mol
Exact Mass322.15
IUPAC Name2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine
SMILESNc1cc(-c2cccc(-c3ccn[nH]3)c2)nc(N2CCOCC2)n1
InChIInChI=1S/C17H18N6O/c18-16-11-15(20-17(21-16)23-6-8-24-9-7-23)13-3-1-2-12(10-13)14-4-5-19-22-14/h1-5,10-11H,6-9H2,(H,19,22)(H2,18,20,21)
InChIKeyUODUEZCYYQQGPI-UHFFFAOYSA-N
XLogP1.95
TPSA92.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-oxa-7-azaspiro[2.5]octan-7-yl)-7-[3-(1H-pyrazol-5-yl)phenyl]pyrido[2,3-d]pyrimidin-4-amine
CID 155631501
methanidylbenzene;2-morpholin-4-yl-6-phenylpyrimidin-4-amine;uranium(2+)
CID 163894008
6-(2-aminopyrimidin-5-yl)-2-morpholin-4-yl-N-(1H-pyrazol-5-yl)pyrimidin-4-amine
CID 42613649
4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine
CID 50982860
2-morpholin-4-yl-6-[2-(morpholin-4-ylmethyl)phenyl]pyrimidin-4-amine
CID 74235769
5-morpholin-4-yl-2-phenylimidazo[1,2-c]pyrimidin-7-amine;2-morpholin-4-ylpyrimidine-4,6-diamine
CID 157107693
4-[3-[3-phenyl-2-(1H-pyrazol-5-yl)imidazo[4,5-b]pyridin-5-yl]phenyl]morpholine
CID 71138371
4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine
CID 144697209
5-(3-pyrrolidin-1-ylphenyl)-1H-pyrazole
CID 141365895
4-[4-(3-nitrophenyl)pyrimidin-2-yl]morpholine
CID 66493906
2-morpholin-4-yl-6-phenylpyrimidine-4-carbonitrile
CID 698584
4-[5-(3-propan-2-yloxyphenyl)-1H-1,2,4-triazol-3-yl]morpholine
CID 157015654

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine?
The IUPAC name of 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine (CID 29182338) is 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine.
What is the SMILES notation for 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine?
The canonical SMILES for 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine is Nc1cc(-c2cccc(-c3ccn[nH]3)c2)nc(N2CCOCC2)n1.
What is the InChIKey of 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine?
The InChIKey is UODUEZCYYQQGPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6O/c18-16-11-15(20-17(21-16)23-6-8-24-9-7-23)13-3-1-2-12(10-13)14-4-5-19-22-14/h1-5,10-11H,6-9H2,(H,19,22)(H2,18,20,21).
What are the key properties of 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine?
2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine has a molecular weight of 322.37 g/mol, XLogP of 1.95, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine is sourced from PubChem (CID 29182338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).