cyclohexylmethyl N-quinolin-7-ylcarbamate

C17H20N2O2 — CID 69258697

IUPACcyclohexylmethyl N-quinolin-7-ylcarbamate
SMILESO=C(Nc1ccc2cccnc2c1)OCC1CCCCC1
InChIInChI=1S/C17H20N2O2/c20-17(21-12-13-5-2-1-3-6-13)19-15-9-8-14-7-4-10-18-16(14)11-15/h4,7-11,13H,1-3,5-6,12H2,(H,19,20)
InChIKeyRTQCLGRQCBTUJO-UHFFFAOYSA-N
MW284.36 g/mol
LogP4.36
Rot. Bonds3

About cyclohexylmethyl N-quinolin-7-ylcarbamate

cyclohexylmethyl N-quinolin-7-ylcarbamate (PubChem CID 69258697) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is cyclohexylmethyl N-quinolin-7-ylcarbamate.

Molecular Properties

Compound Namecyclohexylmethyl N-quinolin-7-ylcarbamate
PubChem CID69258697
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Namecyclohexylmethyl N-quinolin-7-ylcarbamate
SMILESO=C(Nc1ccc2cccnc2c1)OCC1CCCCC1
InChIInChI=1S/C17H20N2O2/c20-17(21-12-13-5-2-1-3-6-13)19-15-9-8-14-7-4-10-18-16(14)11-15/h4,7-11,13H,1-3,5-6,12H2,(H,19,20)
InChIKeyRTQCLGRQCBTUJO-UHFFFAOYSA-N
XLogP4.36
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-1-methyl-3-quinolin-7-ylurea
CID 69259812
cyclohexylmethyl N-(3-chlorophenyl)carbamate
CID 27108719
(2,5-dioxopyrrolidin-1-yl) N-quinolin-7-ylcarbamate
CID 121232305
cyclohexylmethyl N-(1H-pyrrolo[3,2-b]pyridin-3-yl)carbamate
CID 154652727
2-(cyclopropylmethylamino)-N-quinolin-6-ylacetamide
CID 62634785
(2-cyclopentyl-1-quinolin-7-ylethyl)hydrazine
CID 105327558
ethane;N-quinolin-7-ylpentanamide
CID 156648097
cyclohexylmethyl 2-fluoropyridine-3-carboxylate
CID 107271838
cyclopentylmethyl 3-aminopyridine-2-carboxylate
CID 103993262
1-[[(3R)-1-(3-methoxypropyl)pyrrolidin-3-yl]methyl]-3-quinolin-7-ylurea
CID 97444304
cyclohexylmethanol;cyclohexylmethyl N-phenylcarbamate;methane;methylidene(phenylcarbamoyl)oxidanium
CID 161173437
methyl N-benzo[h]quinolin-9-ylcarbamate
CID 102128931

Frequently Asked Questions

What is the IUPAC name of cyclohexylmethyl N-quinolin-7-ylcarbamate?
The IUPAC name of cyclohexylmethyl N-quinolin-7-ylcarbamate (CID 69258697) is cyclohexylmethyl N-quinolin-7-ylcarbamate.
What is the SMILES notation for cyclohexylmethyl N-quinolin-7-ylcarbamate?
The canonical SMILES for cyclohexylmethyl N-quinolin-7-ylcarbamate is O=C(Nc1ccc2cccnc2c1)OCC1CCCCC1.
What is the InChIKey of cyclohexylmethyl N-quinolin-7-ylcarbamate?
The InChIKey is RTQCLGRQCBTUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c20-17(21-12-13-5-2-1-3-6-13)19-15-9-8-14-7-4-10-18-16(14)11-15/h4,7-11,13H,1-3,5-6,12H2,(H,19,20).
What are the key properties of cyclohexylmethyl N-quinolin-7-ylcarbamate?
cyclohexylmethyl N-quinolin-7-ylcarbamate has a molecular weight of 284.36 g/mol, XLogP of 4.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethyl N-quinolin-7-ylcarbamate is sourced from PubChem (CID 69258697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).