N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine

C23H22N10O — CID 90906895

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine
SMILESCc1cn2c(Nc3cc(C4CC4)[nH]n3)nc(-c3cnn(CN4C=Cc5oncc5C4)c3)cc2n1
InChIInChI=1S/C23H22N10O/c1-14-10-33-22(26-14)7-18(27-23(33)28-21-6-19(29-30-21)15-2-3-15)16-8-24-32(12-16)13-31-5-4-20-17(11-31)9-25-34-20/h4-10,12,15H,2-3,11,13H2,1H3,(H2,27,28,29,30)
InChIKeyMCSHBYCHDIQPGK-UHFFFAOYSA-N
MW454.50 g/mol
LogP3.68
Rot. Bonds6

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine (PubChem CID 90906895) has the molecular formula C23H22N10O and a molecular weight of 454.50 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine
PubChem CID90906895
Molecular FormulaC23H22N10O
Molecular Weight454.50 g/mol
Exact Mass454.20
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine
SMILESCc1cn2c(Nc3cc(C4CC4)[nH]n3)nc(-c3cnn(CN4C=Cc5oncc5C4)c3)cc2n1
InChIInChI=1S/C23H22N10O/c1-14-10-33-22(26-14)7-18(27-23(33)28-21-6-19(29-30-21)15-2-3-15)16-8-24-32(12-16)13-31-5-4-20-17(11-31)9-25-34-20/h4-10,12,15H,2-3,11,13H2,1H3,(H2,27,28,29,30)
InChIKeyMCSHBYCHDIQPGK-UHFFFAOYSA-N
XLogP3.68
TPSA117.99 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.50
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine with MolForge

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Related Compounds

5-methyl-N-(3-(1-methyl-1H-pyrazol-4-yl)-5-(piperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl)isoxazol-3-amine
CID 24824680
3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(3-methyl-1,2-oxazol-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine
CID 62706470
1-[5-(4-Amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)imidazo[1,2-a]pyridin-8-yl]-3-[5-[1-(trifluoromethyl)cyclopropyl]-1,2-oxazol-3-yl]urea
CID 171090844
1-[5-(4-Amino-1-prop-2-enylpyrazolo[3,4-d]pyrimidin-3-yl)imidazo[1,2-a]pyridin-8-yl]-3-[5-[1-(trifluoromethyl)cyclopropyl]-1,2-oxazol-3-yl]urea
CID 171091176
1-[5-(4-Methyl-1-prop-2-enylpyrazolo[3,4-d]pyrimidin-3-yl)imidazo[1,2-a]pyridin-8-yl]-3-[5-[1-(trifluoromethyl)cyclopropyl]-1,2-oxazol-3-yl]urea
CID 177194499
N-{1-[(imidazo[1,2-a]pyridin-2-yl)methyl]-1H-pyrazol-4-yl}-N'-(5-methyl-1,2-oxazol-3-yl)urea
CID 51106194
(2S)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]-2-methyl-N-(3-methyl-1,2-oxazol-5-yl)pyrrolidine-2-carboxamide
CID 57680521
(2S)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]-2-methyl-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide
CID 57680544
N-(5-tert-Butyl-isoxazol-3-yl)-2-{4-[7-(1H-pyrazol-4-yl)-imidazo[1,2-a]pyridin-3-yl]-phenyl}-acetamide
CID 57863431
N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine
CID 58364677
N-[5-cyclohexyl-3-(1-methylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine
CID 58364874
(5-methyl-1,2-oxazol-4-yl)-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]piperazin-1-yl]methanone
CID 58532825

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine (CID 90906895) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine is Cc1cn2c(Nc3cc(C4CC4)[nH]n3)nc(-c3cnn(CN4C=Cc5oncc5C4)c3)cc2n1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine?
The InChIKey is MCSHBYCHDIQPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N10O/c1-14-10-33-22(26-14)7-18(27-23(33)28-21-6-19(29-30-21)15-2-3-15)16-8-24-32(12-16)13-31-5-4-20-17(11-31)9-25-34-20/h4-10,12,15H,2-3,11,13H2,1H3,(H2,27,28,29,30).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine has a molecular weight of 454.50 g/mol, XLogP of 3.68, 6 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methyl-7-[1-(4H-[1,2]oxazolo[4,5-c]pyridin-5-ylmethyl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine is sourced from PubChem (CID 90906895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).