N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide

C18H23N3O2 — CID 17411616

IUPACN-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide
SMILESCc1nc(OCC(=O)NC2CCCCC2C)c2ccccc2n1
InChIInChI=1S/C18H23N3O2/c1-12-7-3-5-9-15(12)21-17(22)11-23-18-14-8-4-6-10-16(14)19-13(2)20-18/h4,6,8,10,12,15H,3,5,7,9,11H2,1-2H3,(H,21,22)
InChIKeyCHQMLDSNIMTPOQ-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.01
Rot. Bonds4

About N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide

N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide (PubChem CID 17411616) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide
PubChem CID17411616
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC NameN-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide
SMILESCc1nc(OCC(=O)NC2CCCCC2C)c2ccccc2n1
InChIInChI=1S/C18H23N3O2/c1-12-7-3-5-9-15(12)21-17(22)11-23-18-14-8-4-6-10-16(14)19-13(2)20-18/h4,6,8,10,12,15H,3,5,7,9,11H2,1-2H3,(H,21,22)
InChIKeyCHQMLDSNIMTPOQ-UHFFFAOYSA-N
XLogP3.01
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S,2S)-2-methylcyclohexyl]-2-quinazolin-4-yloxyacetamide
CID 2693322
N-[(1S,2R)-2-methylcyclohexyl]-2-naphthalen-1-yloxyacetamide
CID 2504510
[2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxoethyl] 2,4-dimethylquinoline-3-carboxylate
CID 8825196
N-[(1S,2S)-2-methylcyclohexyl]-2-naphthalen-2-yloxyacetamide
CID 2517702
[2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl] 2-chloroquinoline-4-carboxylate
CID 9009469
N-[[(1R,2R)-2-methylcyclohexyl]carbamoyl]-2-(2-methylquinazolin-4-yl)sulfanylacetamide
CID 7145941
N-[(1S,2R)-2-methylcyclohexyl]-2-(2-phenylphenoxy)acetamide
CID 7478838
2-(2-methoxyphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
CID 7834380
[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl] 1,2,3,4-tetrahydroacridine-9-carboxylate
CID 7889895
N-(3,5-dimethylphenyl)-2-(2-methylquinazolin-4-yl)oxyacetamide
CID 46391582
[2-[(2-methylcyclohexyl)amino]-2-oxoethyl] anthracene-9-carboxylate
CID 4846229
[2-[[(1S,2R)-2-methylcyclohexyl]amino]-2-oxoethyl] 2-(2,6-dimethylphenoxy)acetate
CID 8527913

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide?
The IUPAC name of N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide (CID 17411616) is N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide.
What is the SMILES notation for N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide?
The canonical SMILES for N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide is Cc1nc(OCC(=O)NC2CCCCC2C)c2ccccc2n1.
What is the InChIKey of N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide?
The InChIKey is CHQMLDSNIMTPOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-12-7-3-5-9-15(12)21-17(22)11-23-18-14-8-4-6-10-16(14)19-13(2)20-18/h4,6,8,10,12,15H,3,5,7,9,11H2,1-2H3,(H,21,22).
What are the key properties of N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide?
N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide has a molecular weight of 313.40 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclohexyl)-2-(2-methylquinazolin-4-yl)oxyacetamide is sourced from PubChem (CID 17411616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).