N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine

C16H20N4 — CID 81312553

IUPACN-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine
SMILESCCNc1nc(-c2ccc(C)cn2)nc2c1CCCC2
InChIInChI=1S/C16H20N4/c1-3-17-15-12-6-4-5-7-13(12)19-16(20-15)14-9-8-11(2)10-18-14/h8-10H,3-7H2,1-2H3,(H,17,19,20)
InChIKeyMESUZVHSXXWKAA-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.16
Rot. Bonds3

About N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine

N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine (PubChem CID 81312553) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine
PubChem CID81312553
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC NameN-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine
SMILESCCNc1nc(-c2ccc(C)cn2)nc2c1CCCC2
InChIInChI=1S/C16H20N4/c1-3-17-15-12-6-4-5-7-13(12)19-16(20-15)14-9-8-11(2)10-18-14/h8-10H,3-7H2,1-2H3,(H,17,19,20)
InChIKeyMESUZVHSXXWKAA-UHFFFAOYSA-N
XLogP3.16
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-methyl-2-pyridinyl)-N-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 81311695
[2-(5-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 81312713
N-ethyl-2-pyridin-2-yl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 63351510
2-(2,4-dimethylphenyl)-N-ethyl-5,6,7,8-tetrahydroquinazolin-4-amine
CID 63480845
2-(2,5-dimethylphenyl)-N-ethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62203197
N-ethyl-2-pyrazin-2-yl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 63351468
N,5-diethyl-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidin-4-amine
CID 81311692
2-(3,4-dimethylphenyl)-N-ethyl-5,6,7,8-tetrahydroquinazolin-4-amine
CID 63480001
N-ethyl-2-(5-fluoro-2-methylphenyl)-5,6,7,8-tetrahydroquinazolin-4-amine
CID 63485255
N-ethyl-2-(5-methylthiophen-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 63480179
2-(4-bromo-3-methylphenyl)-N-ethyl-5,6,7,8-tetrahydroquinazolin-4-amine
CID 66479077
2-(5-chloro-2-pyridinyl)-N-ethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
CID 106472466

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine?
The IUPAC name of N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine (CID 81312553) is N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine.
What is the SMILES notation for N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine?
The canonical SMILES for N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine is CCNc1nc(-c2ccc(C)cn2)nc2c1CCCC2.
What is the InChIKey of N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine?
The InChIKey is MESUZVHSXXWKAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-3-17-15-12-6-4-5-7-13(12)19-16(20-15)14-9-8-11(2)10-18-14/h8-10H,3-7H2,1-2H3,(H,17,19,20).
What are the key properties of N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine?
N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine has a molecular weight of 268.36 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinazolin-4-amine is sourced from PubChem (CID 81312553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).