N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide

C18H24N2O2 — CID 4938931

IUPACN-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1NC(=O)C1CC1)C1CCCCC1
InChIInChI=1S/C18H24N2O2/c1-20(14-7-3-2-4-8-14)18(22)15-9-5-6-10-16(15)19-17(21)13-11-12-13/h5-6,9-10,13-14H,2-4,7-8,11-12H2,1H3,(H,19,21)
InChIKeyORNNHLNUCPWCAL-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.44
Rot. Bonds4

About N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide

N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide (PubChem CID 4938931) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide
PubChem CID4938931
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1NC(=O)C1CC1)C1CCCCC1
InChIInChI=1S/C18H24N2O2/c1-20(14-7-3-2-4-8-14)18(22)15-9-5-6-10-16(15)19-17(21)13-11-12-13/h5-6,9-10,13-14H,2-4,7-8,11-12H2,1H3,(H,19,21)
InChIKeyORNNHLNUCPWCAL-UHFFFAOYSA-N
XLogP3.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide?
The IUPAC name of N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide (CID 4938931) is N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide.
What is the SMILES notation for N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide?
The canonical SMILES for N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide is CN(C(=O)c1ccccc1NC(=O)C1CC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide?
The InChIKey is ORNNHLNUCPWCAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-20(14-7-3-2-4-8-14)18(22)15-9-5-6-10-16(15)19-17(21)13-11-12-13/h5-6,9-10,13-14H,2-4,7-8,11-12H2,1H3,(H,19,21).
What are the key properties of N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide?
N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide has a molecular weight of 300.40 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide is sourced from PubChem (CID 4938931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).