2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine

C17H22N2O2 — CID 43781692

IUPAC2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine
SMILESCOC1CCCCC1Nc1ccc2oc(C3CC3)nc2c1
InChIInChI=1S/C17H22N2O2/c1-20-15-5-3-2-4-13(15)18-12-8-9-16-14(10-12)19-17(21-16)11-6-7-11/h8-11,13,15,18H,2-7H2,1H3
InChIKeyYMODWEQYIFPTIO-UHFFFAOYSA-N
MW286.37 g/mol
LogP4.07
Rot. Bonds4

About 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine

2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine (PubChem CID 43781692) has the molecular formula C17H22N2O2 and a molecular weight of 286.37 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine
PubChem CID43781692
Molecular FormulaC17H22N2O2
Molecular Weight286.37 g/mol
Exact Mass286.17
IUPAC Name2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine
SMILESCOC1CCCCC1Nc1ccc2oc(C3CC3)nc2c1
InChIInChI=1S/C17H22N2O2/c1-20-15-5-3-2-4-13(15)18-12-8-9-16-14(10-12)19-17(21-16)11-6-7-11/h8-11,13,15,18H,2-7H2,1H3
InChIKeyYMODWEQYIFPTIO-UHFFFAOYSA-N
XLogP4.07
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Launch Full Analysis

Related Compounds

N-(2-methoxycyclohexyl)-2-methyl-1,3-benzoxazol-5-amine
CID 43769788
N-cyclooctyl-2-cyclopropyl-1,3-benzoxazol-5-amine
CID 43686416
2-cyclopropyl-N-(oxan-4-yl)-1,3-benzoxazol-5-amine
CID 43686399
2-cyclopropyl-N-(2-morpholin-3-ylcyclopentyl)-1,3-benzoxazol-5-amine;hydrochloride
CID 120916052
2-cyclopropyl-N-(oxepan-4-yl)-1,3-benzoxazol-5-amine
CID 65081682
2-cyclopropyl-N-[4-methyl-2-(1,2,4-triazol-1-yl)cyclohexyl]-1,3-benzoxazol-5-amine
CID 167924650
2-cyclopropyl-N-(piperidin-4-ylmethyl)-1,3-benzoxazol-5-amine
CID 79701065
1-cyclooctyl-3-(2-cyclopropyl-1,3-benzoxazol-5-yl)urea
CID 71895854
N-(2-methoxycyclohexyl)-1H-indol-5-amine
CID 43768693
2-cyclopropyl-N-(oxolan-2-ylmethyl)-1,3-benzoxazol-5-amine
CID 82834532
2-cyclopropyl-N-[1-(1H-pyrazol-5-yl)ethyl]-1,3-benzoxazol-5-amine
CID 60972062
2-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]-1,3-benzoxazol-5-amine
CID 115918873

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine?
The IUPAC name of 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine (CID 43781692) is 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine.
What is the SMILES notation for 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine?
The canonical SMILES for 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine is COC1CCCCC1Nc1ccc2oc(C3CC3)nc2c1.
What is the InChIKey of 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine?
The InChIKey is YMODWEQYIFPTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-20-15-5-3-2-4-13(15)18-12-8-9-16-14(10-12)19-17(21-16)11-6-7-11/h8-11,13,15,18H,2-7H2,1H3.
What are the key properties of 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine?
2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine has a molecular weight of 286.37 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2-methoxycyclohexyl)-1,3-benzoxazol-5-amine is sourced from PubChem (CID 43781692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).