2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine

C16H18N4O — CID 8852996

IUPAC2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine
SMILESCc1cc2nc(NC[C@H]3CCCO3)c3ccccc3n2n1
InChIInChI=1S/C16H18N4O/c1-11-9-15-18-16(17-10-12-5-4-8-21-12)13-6-2-3-7-14(13)20(15)19-11/h2-3,6-7,9,12H,4-5,8,10H2,1H3,(H,17,18)/t12-/m1/s1
InChIKeyPKPRJYWLUHMDCP-GFCCVEGCSA-N
MW282.35 g/mol
LogP2.78
Rot. Bonds3

About 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine

2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine (PubChem CID 8852996) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine.

Molecular Properties

Compound Name2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine
PubChem CID8852996
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine
SMILESCc1cc2nc(NC[C@H]3CCCO3)c3ccccc3n2n1
InChIInChI=1S/C16H18N4O/c1-11-9-15-18-16(17-10-12-5-4-8-21-12)13-6-2-3-7-14(13)20(15)19-11/h2-3,6-7,9,12H,4-5,8,10H2,1H3,(H,17,18)/t12-/m1/s1
InChIKeyPKPRJYWLUHMDCP-GFCCVEGCSA-N
XLogP2.78
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-(3-morpholin-4-ylpropyl)pyrazolo[1,5-a]quinazolin-5-amine
CID 34044453
3-(3-bromophenyl)-N-[[(2S)-oxolan-2-yl]methyl]triazolo[1,5-a]quinazolin-5-amine
CID 2150167
N-[[(2S)-oxolan-2-yl]methyl]-3-[3-(trifluoromethyl)phenyl]triazolo[1,5-a]quinazolin-5-amine
CID 92666906
4-(oxolan-2-ylmethylamino)-1H-quinazoline-2-thione
CID 23827546
N-[(2-methoxyphenyl)methyl]-2-methylpyrazolo[1,5-a]quinazolin-5-amine
CID 8850825
N-(oxolan-2-ylmethyl)-2-piperidin-1-ylquinazolin-4-amine
CID 3156007
2-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridine-3-carbonitrile
CID 133462550
2-[2-[(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]ethylamino]pyridine-3-carbonitrile
CID 51119677
2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]pyrazolo[1,5-a]quinazolin-5-amine
CID 71891768
3-methyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 62254757
2-N-(4-chloro-2-methylphenyl)-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine
CID 56729091
(2S)-1,1,1-trifluoro-2-(5-methylfuran-2-yl)-4-[(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]butan-2-ol
CID 99786902

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine?
The IUPAC name of 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine (CID 8852996) is 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine.
What is the SMILES notation for 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine?
The canonical SMILES for 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine is Cc1cc2nc(NC[C@H]3CCCO3)c3ccccc3n2n1.
What is the InChIKey of 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine?
The InChIKey is PKPRJYWLUHMDCP-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H18N4O/c1-11-9-15-18-16(17-10-12-5-4-8-21-12)13-6-2-3-7-14(13)20(15)19-11/h2-3,6-7,9,12H,4-5,8,10H2,1H3,(H,17,18)/t12-/m1/s1.
What are the key properties of 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine?
2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine has a molecular weight of 282.35 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazolo[1,5-a]quinazolin-5-amine is sourced from PubChem (CID 8852996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).