2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine

C13H19N3O — CID 62008084

IUPAC2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESNC1CCCc2nc(CC3CCCO3)ncc21
InChIInChI=1S/C13H19N3O/c14-11-4-1-5-12-10(11)8-15-13(16-12)7-9-3-2-6-17-9/h8-9,11H,1-7,14H2
InChIKeyDSYSVVFBDWUSLX-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.53
Rot. Bonds2

About 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine

2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine (PubChem CID 62008084) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine.

Molecular Properties

Compound Name2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine
PubChem CID62008084
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESNC1CCCc2nc(CC3CCCO3)ncc21
InChIInChI=1S/C13H19N3O/c14-11-4-1-5-12-10(11)8-15-13(16-12)7-9-3-2-6-17-9/h8-9,11H,1-7,14H2
InChIKeyDSYSVVFBDWUSLX-UHFFFAOYSA-N
XLogP1.53
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(oxolan-2-ylmethyl)-N-propyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-5-amine
CID 107385419
2-(oxolan-2-ylmethyl)pyrimidin-5-amine
CID 43142229
2-(2-phenylethyl)-5,6,7,8-tetrahydroquinazolin-5-amine
CID 62009060
2-(2-methoxyethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-5-amine
CID 107384959
2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117155468
2-[[(2S)-oxolan-2-yl]methyl]-7H-purine
CID 175976285
2-[(2-bromophenyl)methyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-5-amine
CID 107384927
2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine
CID 62008280
5-methyl-2-(oxolan-2-ylmethyl)pyrimidine-4-carboxylic acid
CID 165447270
6-(oxolan-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 112681350
2-[(2-chloro-6-fluorophenyl)methyl]-5,6,7,8-tetrahydroquinazolin-5-amine
CID 63023527
2-(oxan-2-ylmethyl)-4-(trifluoromethyl)pyrimidin-5-amine
CID 114207086

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine?
The IUPAC name of 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine (CID 62008084) is 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine.
What is the SMILES notation for 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine?
The canonical SMILES for 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine is NC1CCCc2nc(CC3CCCO3)ncc21.
What is the InChIKey of 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine?
The InChIKey is DSYSVVFBDWUSLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c14-11-4-1-5-12-10(11)8-15-13(16-12)7-9-3-2-6-17-9/h8-9,11H,1-7,14H2.
What are the key properties of 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine?
2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine has a molecular weight of 233.31 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-5-amine is sourced from PubChem (CID 62008084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).