(5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline

C19H19N3O — CID 135814122

IUPAC(5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
SMILESCOc1ccc([C@@H]2Nc3ccc(C)cc3-c3cc(C)nn32)cc1
InChIInChI=1S/C19H19N3O/c1-12-4-9-17-16(10-12)18-11-13(2)21-22(18)19(20-17)14-5-7-15(23-3)8-6-14/h4-11,19-20H,1-3H3/t19-/m1/s1
InChIKeyQIOJWTJKSACZQN-LJQANCHMSA-N
MW305.38 g/mol
LogP4.15
Rot. Bonds2

About (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline

(5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline (PubChem CID 135814122) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline.

Molecular Properties

Compound Name(5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
PubChem CID135814122
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name(5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
SMILESCOc1ccc([C@@H]2Nc3ccc(C)cc3-c3cc(C)nn32)cc1
InChIInChI=1S/C19H19N3O/c1-12-4-9-17-16(10-12)18-11-13(2)21-22(18)19(20-17)14-5-7-15(23-3)8-6-14/h4-11,19-20H,1-3H3/t19-/m1/s1
InChIKeyQIOJWTJKSACZQN-LJQANCHMSA-N
XLogP4.15
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-ethoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 3158691
5-(4-methoxyphenyl)-2-methyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 3158652
2-(2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)-5-methoxyphenol
CID 3878015
4-[4-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenyl]morpholine
CID 135726038
4-(2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)-2-ethoxyphenol
CID 4546081
5-(furan-2-yl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 3556244
5-(4-ethoxyphenyl)-2-methyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 3158655
4-bromo-2-[(5S)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenol
CID 982265
4-[(5S)-2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]phenol
CID 1095515
2,9-dimethyl-5-[2-(trifluoromethyl)phenyl]-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 5043160
N,N-dimethyl-4-[(5S)-2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl]aniline
CID 1095488
5-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-2-methyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 3589959

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
The IUPAC name of (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline (CID 135814122) is (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline.
What is the SMILES notation for (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
The canonical SMILES for (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline is COc1ccc([C@@H]2Nc3ccc(C)cc3-c3cc(C)nn32)cc1.
What is the InChIKey of (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
The InChIKey is QIOJWTJKSACZQN-LJQANCHMSA-N. The full InChI is InChI=1S/C19H19N3O/c1-12-4-9-17-16(10-12)18-11-13(2)21-22(18)19(20-17)14-5-7-15(23-3)8-6-14/h4-11,19-20H,1-3H3/t19-/m1/s1.
What are the key properties of (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
(5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline has a molecular weight of 305.38 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(4-methoxyphenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline is sourced from PubChem (CID 135814122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).