N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine

C15H19N5 — CID 62009879

IUPACN-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESCCCNC1CCCc2nc(-c3ncccn3)ncc21
InChIInChI=1S/C15H19N5/c1-2-7-16-12-5-3-6-13-11(12)10-19-15(20-13)14-17-8-4-9-18-14/h4,8-10,12,16H,2-3,5-7H2,1H3
InChIKeyBHMAZEOPUDIASX-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.31
Rot. Bonds4

About N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine

N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine (PubChem CID 62009879) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine.

Molecular Properties

Compound NameN-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine
PubChem CID62009879
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC NameN-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESCCCNC1CCCc2nc(-c3ncccn3)ncc21
InChIInChI=1S/C15H19N5/c1-2-7-16-12-5-3-6-13-11(12)10-19-15(20-13)14-17-8-4-9-18-14/h4,8-10,12,16H,2-3,5-7H2,1H3
InChIKeyBHMAZEOPUDIASX-UHFFFAOYSA-N
XLogP2.31
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine?
The IUPAC name of N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine (CID 62009879) is N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine.
What is the SMILES notation for N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine?
The canonical SMILES for N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine is CCCNC1CCCc2nc(-c3ncccn3)ncc21.
What is the InChIKey of N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine?
The InChIKey is BHMAZEOPUDIASX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-2-7-16-12-5-3-6-13-11(12)10-19-15(20-13)14-17-8-4-9-18-14/h4,8-10,12,16H,2-3,5-7H2,1H3.
What are the key properties of N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine?
N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine has a molecular weight of 269.35 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-pyrimidin-2-yl-5,6,7,8-tetrahydroquinazolin-5-amine is sourced from PubChem (CID 62009879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).