2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine

C19H18N4 — CID 8892490

IUPAC2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine
SMILESCc1cc2nc(N[C@@H](C)c3ccccc3)c3ccccc3n2n1
InChIInChI=1S/C19H18N4/c1-13-12-18-21-19(20-14(2)15-8-4-3-5-9-15)16-10-6-7-11-17(16)23(18)22-13/h3-12,14H,1-2H3,(H,20,21)/t14-/m0/s1
InChIKeyCDTRCQAWDLDIBE-AWEZNQCLSA-N
MW302.38 g/mol
LogP4.36
Rot. Bonds3

About 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine

2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine (PubChem CID 8892490) has the molecular formula C19H18N4 and a molecular weight of 302.38 g/mol. Its IUPAC name is 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine.

Molecular Properties

Compound Name2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine
PubChem CID8892490
Molecular FormulaC19H18N4
Molecular Weight302.38 g/mol
Exact Mass302.15
IUPAC Name2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine
SMILESCc1cc2nc(N[C@@H](C)c3ccccc3)c3ccccc3n2n1
InChIInChI=1S/C19H18N4/c1-13-12-18-21-19(20-14(2)15-8-4-3-5-9-15)16-10-6-7-11-17(16)23(18)22-13/h3-12,14H,1-2H3,(H,20,21)/t14-/m0/s1
InChIKeyCDTRCQAWDLDIBE-AWEZNQCLSA-N
XLogP4.36
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S)-1-(2-methoxyphenyl)ethyl]-2-methylpyrazolo[1,5-a]quinazolin-5-amine
CID 8890761
2-methyl-N-[(1S)-1-(5-methylthiophen-2-yl)ethyl]pyrazolo[1,5-a]quinazolin-5-amine
CID 95068261
N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-2-methylpyrazolo[1,5-a]quinazolin-5-amine
CID 8890755
N-[(1R)-1-(2-methoxy-5-methylphenyl)ethyl]-2-methylpyrazolo[1,5-a]quinazolin-5-amine
CID 94874302
2-methyl-N-[(4-methylphenyl)methyl]pyrazolo[1,5-a]quinazolin-5-amine
CID 8850832
N-[(2-methoxyphenyl)methyl]-2-methylpyrazolo[1,5-a]quinazolin-5-amine
CID 8850825
N-[(S)-cyclopropyl-(5-methyl-1,3-thiazol-2-yl)methyl]-2-methylpyrazolo[1,5-a]quinazolin-5-amine
CID 95781512
3-(4-methylphenyl)sulfonyl-N-[(1S)-1-phenylethyl]triazolo[1,5-a]quinazolin-5-amine
CID 51605746
N-[(3,4-dichlorophenyl)methyl]-2-methylpyrazolo[1,5-a]quinazolin-5-amine
CID 172862616
2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine
CID 8852996
N-[2-(cyclohexen-1-yl)ethyl]-2-methylpyrazolo[1,5-a]quinazolin-5-amine
CID 8890756
2,2-dimethyl-N-[2-[(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]ethyl]propanamide
CID 99792474

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine?
The IUPAC name of 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine (CID 8892490) is 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine.
What is the SMILES notation for 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine?
The canonical SMILES for 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine is Cc1cc2nc(N[C@@H](C)c3ccccc3)c3ccccc3n2n1.
What is the InChIKey of 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine?
The InChIKey is CDTRCQAWDLDIBE-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H18N4/c1-13-12-18-21-19(20-14(2)15-8-4-3-5-9-15)16-10-6-7-11-17(16)23(18)22-13/h3-12,14H,1-2H3,(H,20,21)/t14-/m0/s1.
What are the key properties of 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine?
2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine has a molecular weight of 302.38 g/mol, XLogP of 4.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine is sourced from PubChem (CID 8892490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).