[2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol

C15H20N4O — CID 106368258

IUPAC[2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol
SMILESNc1nc(NC2CCCCC2CO)c2ccccc2n1
InChIInChI=1S/C15H20N4O/c16-15-18-13-8-4-2-6-11(13)14(19-15)17-12-7-3-1-5-10(12)9-20/h2,4,6,8,10,12,20H,1,3,5,7,9H2,(H3,16,17,18,19)
InChIKeyMKCBIOQFHOEOSG-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.17
Rot. Bonds3

About [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol

[2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol (PubChem CID 106368258) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol
PubChem CID106368258
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name[2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol
SMILESNc1nc(NC2CCCCC2CO)c2ccccc2n1
InChIInChI=1S/C15H20N4O/c16-15-18-13-8-4-2-6-11(13)14(19-15)17-12-7-3-1-5-10(12)9-20/h2,4,6,8,10,12,20H,1,3,5,7,9H2,(H3,16,17,18,19)
InChIKeyMKCBIOQFHOEOSG-UHFFFAOYSA-N
XLogP2.17
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[(2-aminoquinazolin-4-yl)amino]cyclopentyl]methanol
CID 106368086
2-[(2-aminoquinazolin-4-yl)amino]cyclohexan-1-ol
CID 80827366
[2-[(3-aminoquinoxalin-2-yl)amino]cyclohexyl]methanol
CID 106367963
4-N-(2-methylcyclohexyl)quinazoline-2,4-diamine
CID 80776922
4-N-cyclooctylquinazoline-2,4-diamine
CID 80786546
[(1R,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinazolin-4-yl]amino]cyclohexyl]methanol
CID 154649311
[2-(phthalazin-1-ylamino)cyclohexyl]methanol
CID 106362271
4-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)quinazoline-2,4-diamine
CID 80784788
[2-[(2-amino-5-methylpyrimidin-4-yl)amino]cyclohexyl]methanol
CID 106368178
2-[2-[[2-(difluoromethyl)quinazolin-4-yl]amino]cyclopentyl]ethanol
CID 133496325
4-N-(4-ethylcyclohexyl)quinazoline-2,4-diamine
CID 80803766
[(1R,2S)-2-[[5-amino-2-[(2-methoxyphenyl)methyl]pyrazolo[4,3-d]pyrimidin-7-yl]amino]cyclopentyl]methanol
CID 168839253

Frequently Asked Questions

What is the IUPAC name of [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol?
The IUPAC name of [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol (CID 106368258) is [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol is Nc1nc(NC2CCCCC2CO)c2ccccc2n1.
What is the InChIKey of [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol?
The InChIKey is MKCBIOQFHOEOSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c16-15-18-13-8-4-2-6-11(13)14(19-15)17-12-7-3-1-5-10(12)9-20/h2,4,6,8,10,12,20H,1,3,5,7,9H2,(H3,16,17,18,19).
What are the key properties of [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol?
[2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol has a molecular weight of 272.35 g/mol, XLogP of 2.17, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 106368258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).