8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine

C16H19N3 — CID 104609460

IUPAC8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine
SMILESCCC1CCCc2cnc(Nc3ccccc3)nc21
InChIInChI=1S/C16H19N3/c1-2-12-7-6-8-13-11-17-16(19-15(12)13)18-14-9-4-3-5-10-14/h3-5,9-12H,2,6-8H2,1H3,(H,17,18,19)
InChIKeyMMHLSTAVUXLIOA-UHFFFAOYSA-N
MW253.35 g/mol
LogP4.05
Rot. Bonds3

About 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine

8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine (PubChem CID 104609460) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine.

Molecular Properties

Compound Name8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine
PubChem CID104609460
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine
SMILESCCC1CCCc2cnc(Nc3ccccc3)nc21
InChIInChI=1S/C16H19N3/c1-2-12-7-6-8-13-11-17-16(19-15(12)13)18-14-9-4-3-5-10-14/h3-5,9-12H,2,6-8H2,1H3,(H,17,18,19)
InChIKeyMMHLSTAVUXLIOA-UHFFFAOYSA-N
XLogP4.05
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine
CID 104609487
6-methyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine
CID 51371057
2-anilino-8-ethyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
CID 18375160
ethanol;N-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-8-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine
CID 161353726
N-phenyl-3,5-diazatricyclo[6.2.1.02,7]undeca-2,4,6-trien-4-amine
CID 104609507
4-N-cyclohexyl-5-methyl-2-N-phenylpyrimidine-2,4-diamine
CID 175747416
7-[(2-anilino-5-methylpyrimidin-4-yl)amino]-3,4-dihydro-2H-naphthalen-1-one
CID 58956294
2-anilino-5-ethyl-7-phenyl-8,9-dihydro-7H-pyrimido[5,4-b]azepin-6-one
CID 143285049
5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine
CID 162748564
5-methyl-4-N-(3-methyl-2,3-dihydro-1H-inden-5-yl)-2-N-phenylpyrimidine-2,4-diamine
CID 59777611
2-benzyl-5,6,7,8-tetrahydroquinazolin-8-amine
CID 115043187
6,6-dioxo-N-phenyl-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-2-amine
CID 104609529

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine?
The IUPAC name of 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine (CID 104609460) is 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine.
What is the SMILES notation for 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine?
The canonical SMILES for 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine is CCC1CCCc2cnc(Nc3ccccc3)nc21.
What is the InChIKey of 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine?
The InChIKey is MMHLSTAVUXLIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c1-2-12-7-6-8-13-11-17-16(19-15(12)13)18-14-9-4-3-5-10-14/h3-5,9-12H,2,6-8H2,1H3,(H,17,18,19).
What are the key properties of 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine?
8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine has a molecular weight of 253.35 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine is sourced from PubChem (CID 104609460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).