2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine

C12H20N4 — CID 62008280

IUPAC2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine
SMILESCCN(CC)c1ncc2c(n1)CCCC2N
InChIInChI=1S/C12H20N4/c1-3-16(4-2)12-14-8-9-10(13)6-5-7-11(9)15-12/h8,10H,3-7,13H2,1-2H3
InChIKeyQCPXNTGCFSYRRV-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.66
Rot. Bonds3

About 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine

2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine (PubChem CID 62008280) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine
PubChem CID62008280
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine
SMILESCCN(CC)c1ncc2c(n1)CCCC2N
InChIInChI=1S/C12H20N4/c1-3-16(4-2)12-14-8-9-10(13)6-5-7-11(9)15-12/h8,10H,3-7,13H2,1-2H3
InChIKeyQCPXNTGCFSYRRV-UHFFFAOYSA-N
XLogP1.66
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine?
The IUPAC name of 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine (CID 62008280) is 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine.
What is the SMILES notation for 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine?
The canonical SMILES for 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine is CCN(CC)c1ncc2c(n1)CCCC2N.
What is the InChIKey of 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine?
The InChIKey is QCPXNTGCFSYRRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-16(4-2)12-14-8-9-10(13)6-5-7-11(9)15-12/h8,10H,3-7,13H2,1-2H3.
What are the key properties of 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine?
2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine has a molecular weight of 220.32 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine is sourced from PubChem (CID 62008280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).