4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine

C24H29N5O — CID 134805785

IUPAC4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine
SMILESCc1nn2c(c1-c1cccnc1N1CCOCC1)N(CCc1ccccc1)CCC2
InChIInChI=1S/C24H29N5O/c1-19-22(21-9-5-11-25-23(21)27-15-17-30-18-16-27)24-28(12-6-13-29(24)26-19)14-10-20-7-3-2-4-8-20/h2-5,7-9,11H,6,10,12-18H2,1H3
InChIKeyZZPAIURUZHFFQI-UHFFFAOYSA-N
MW403.53 g/mol
LogP3.54
Rot. Bonds5

About 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine

4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine (PubChem CID 134805785) has the molecular formula C24H29N5O and a molecular weight of 403.53 g/mol. Its IUPAC name is 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine
PubChem CID134805785
Molecular FormulaC24H29N5O
Molecular Weight403.53 g/mol
Exact Mass403.24
IUPAC Name4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine
SMILESCc1nn2c(c1-c1cccnc1N1CCOCC1)N(CCc1ccccc1)CCC2
InChIInChI=1S/C24H29N5O/c1-19-22(21-9-5-11-25-23(21)27-15-17-30-18-16-27)24-28(12-6-13-29(24)26-19)14-10-20-7-3-2-4-8-20/h2-5,7-9,11H,6,10,12-18H2,1H3
InChIKeyZZPAIURUZHFFQI-UHFFFAOYSA-N
XLogP3.54
TPSA46.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.53
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine with MolForge

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Related Compounds

2-methyl-3-(2-phenylmethoxyphenyl)-4-(pyridin-3-ylmethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidine
CID 134808572
ethane;4-(3-methyl-2-pyridinyl)morpholine
CID 143966357
N-[(3-methyl-1-phenylpyrazol-4-yl)methyl]-2-morpholin-4-ylpyridin-3-amine
CID 75388335
4-[5-(2-phenylethyl)pyrimidin-2-yl]morpholine
CID 138973898
methane;4-(2-phenylethyl)morpholine
CID 143698819
4-[5-(2-phenylethyl)pyrimidin-4-yl]morpholine;hydrochloride
CID 70170771
N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-1-(3-phenoxyphenyl)methanamine;hydrochloride
CID 47030657
1-[1-(2-methylphenyl)ethyl]-3-[(2-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 42954650
1-ethyl-3-[(2-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 47226420
4-[2-[4-(2-phenylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 154829699
4-[1-(2-phenylethyl)benzimidazol-5-yl]morpholine
CID 175767613
1-(2-morpholin-4-yl-3-pyridinyl)propan-2-amine
CID 83890121

Frequently Asked Questions

What is the IUPAC name of 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine?
The IUPAC name of 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine (CID 134805785) is 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine?
The canonical SMILES for 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine is Cc1nn2c(c1-c1cccnc1N1CCOCC1)N(CCc1ccccc1)CCC2.
What is the InChIKey of 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine?
The InChIKey is ZZPAIURUZHFFQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O/c1-19-22(21-9-5-11-25-23(21)27-15-17-30-18-16-27)24-28(12-6-13-29(24)26-19)14-10-20-7-3-2-4-8-20/h2-5,7-9,11H,6,10,12-18H2,1H3.
What are the key properties of 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine?
4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine has a molecular weight of 403.53 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[2-methyl-4-(2-phenylethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-3-yl]-2-pyridinyl]morpholine is sourced from PubChem (CID 134805785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).