N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide

C24H30N2O4 — CID 55879424

IUPACN-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide
SMILESCCOc1cc(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)ccc1OC
InChIInChI=1S/C24H30N2O4/c1-4-30-22-15-18(11-13-21(22)29-3)24(28)26-20-12-10-17(14-16(20)2)23(27)25-19-8-6-5-7-9-19/h10-15,19H,4-9H2,1-3H3,(H,25,27)(H,26,28)
InChIKeyRFVQVWZSCNMBEL-UHFFFAOYSA-N
MW410.51 g/mol
LogP4.72
Rot. Bonds7

About N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide

N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide (PubChem CID 55879424) has the molecular formula C24H30N2O4 and a molecular weight of 410.51 g/mol. Its IUPAC name is N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide
PubChem CID55879424
Molecular FormulaC24H30N2O4
Molecular Weight410.51 g/mol
Exact Mass410.22
IUPAC NameN-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide
SMILESCCOc1cc(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)ccc1OC
InChIInChI=1S/C24H30N2O4/c1-4-30-22-15-18(11-13-21(22)29-3)24(28)26-20-12-10-17(14-16(20)2)23(27)25-19-8-6-5-7-9-19/h10-15,19H,4-9H2,1-3H3,(H,25,27)(H,26,28)
InChIKeyRFVQVWZSCNMBEL-UHFFFAOYSA-N
XLogP4.72
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.51
LogP ≤ 54.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-3-ethoxy-4-methoxybenzamide
CID 2992515
N-cycloheptyl-3-ethoxy-4-methoxybenzamide
CID 24539374
N-cyclohexyl-4-[(3-methoxy-4-propan-2-yloxybenzoyl)amino]-3-methylbenzamide
CID 55992962
N-cyclohexyl-3,4-diethoxybenzamide
CID 917356
N-[4-(cyclopropylcarbamoyl)phenyl]-3-ethoxy-4-methoxybenzamide
CID 51299958
N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride
CID 67897205
N-cyclobutyl-4-methoxy-3-methylbenzamide
CID 121342416
N-cycloheptyl-4-(ethylamino)-3-methylbenzamide
CID 63210563
3-benzamido-N-[4-(cyclohexylcarbamoyl)-2-methylphenyl]-4-methylbenzamide
CID 55878666
3-amino-N-cyclohexyl-4-ethoxybenzamide
CID 28689929
N-cyclopentyl-4-(cyclopropylcarbamoylamino)-3-methylbenzamide
CID 48645772
4-[(2-aminoacetyl)amino]-N-cyclohexyl-3-methylbenzamide;hydrochloride
CID 119283092

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide?
The IUPAC name of N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide (CID 55879424) is N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide.
What is the SMILES notation for N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide?
The canonical SMILES for N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide is CCOc1cc(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)ccc1OC.
What is the InChIKey of N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide?
The InChIKey is RFVQVWZSCNMBEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O4/c1-4-30-22-15-18(11-13-21(22)29-3)24(28)26-20-12-10-17(14-16(20)2)23(27)25-19-8-6-5-7-9-19/h10-15,19H,4-9H2,1-3H3,(H,25,27)(H,26,28).
What are the key properties of N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide?
N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide has a molecular weight of 410.51 g/mol, XLogP of 4.72, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide is sourced from PubChem (CID 55879424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).