2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine

C16H25N3O — CID 116775313

IUPAC2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESCCOC1(c2ncc3c(n2)CCCC3N)CCCCC1
InChIInChI=1S/C16H25N3O/c1-2-20-16(9-4-3-5-10-16)15-18-11-12-13(17)7-6-8-14(12)19-15/h11,13H,2-10,17H2,1H3
InChIKeyUOXZGVOQAHCBOE-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.01
Rot. Bonds3

About 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine

2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine (PubChem CID 116775313) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine.

Molecular Properties

Compound Name2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine
PubChem CID116775313
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESCCOC1(c2ncc3c(n2)CCCC3N)CCCCC1
InChIInChI=1S/C16H25N3O/c1-2-20-16(9-4-3-5-10-16)15-18-11-12-13(17)7-6-8-14(12)19-15/h11,13H,2-10,17H2,1H3
InChIKeyUOXZGVOQAHCBOE-UHFFFAOYSA-N
XLogP3.01
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methoxy-4,4-dimethylcyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine
CID 116775320
2-(1-ethoxycycloheptyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-amine
CID 116774406
2-(1-ethoxyethyl)-5,6,7,8-tetrahydroquinazolin-5-amine
CID 64533818
1-[2-(1-ethoxycyclopentyl)-5,6,7,8-tetrahydroquinazolin-6-yl]-N-methylmethanamine
CID 116779494
2-N,2-N-diethyl-5,6,7,8-tetrahydroquinazoline-2,5-diamine
CID 62008280
4-chloro-2-(1-ethoxycyclohexyl)-5-iodopyrimidine
CID 116746306
2-[2-(1-ethoxycycloheptyl)pyrimidin-5-yl]ethanamine
CID 116779217
2-(1-ethoxycyclopentyl)-4-propan-2-ylpyrimidin-5-amine
CID 114207193
ethyl 4-amino-2-(1-ethoxycyclohexyl)pyrimidine-5-carboxylate
CID 116782888
5-(bromomethyl)-4-cyclopropyl-2-(1-ethoxycyclopentyl)pyrimidine
CID 114205823
2-(1-ethoxycycloheptyl)-4-ethylpyrimidine-5-carboxylic acid
CID 116775102
2-(1-ethoxycyclopentyl)pyrimidin-4-amine
CID 116775700

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine?
The IUPAC name of 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine (CID 116775313) is 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine.
What is the SMILES notation for 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine?
The canonical SMILES for 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine is CCOC1(c2ncc3c(n2)CCCC3N)CCCCC1.
What is the InChIKey of 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine?
The InChIKey is UOXZGVOQAHCBOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-2-20-16(9-4-3-5-10-16)15-18-11-12-13(17)7-6-8-14(12)19-15/h11,13H,2-10,17H2,1H3.
What are the key properties of 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine?
2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine has a molecular weight of 275.40 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethoxycyclohexyl)-5,6,7,8-tetrahydroquinazolin-5-amine is sourced from PubChem (CID 116775313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).