1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide

C24H30N2O4 — CID 60594031

IUPAC1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide
SMILESCOc1ccc(C)cc1NC(=O)C1CCCC(C(=O)Nc2cc(C)ccc2OC)C1
InChIInChI=1S/C24H30N2O4/c1-15-8-10-21(29-3)19(12-15)25-23(27)17-6-5-7-18(14-17)24(28)26-20-13-16(2)9-11-22(20)30-4/h8-13,17-18H,5-7,14H2,1-4H3,(H,25,27)(H,26,28)
InChIKeyUHMYCHSTZWCFCP-UHFFFAOYSA-N
MW410.51 g/mol
LogP4.70
Rot. Bonds6

About 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide

1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide (PubChem CID 60594031) has the molecular formula C24H30N2O4 and a molecular weight of 410.51 g/mol. Its IUPAC name is 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide
PubChem CID60594031
Molecular FormulaC24H30N2O4
Molecular Weight410.51 g/mol
Exact Mass410.22
IUPAC Name1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide
SMILESCOc1ccc(C)cc1NC(=O)C1CCCC(C(=O)Nc2cc(C)ccc2OC)C1
InChIInChI=1S/C24H30N2O4/c1-15-8-10-21(29-3)19(12-15)25-23(27)17-6-5-7-18(14-17)24(28)26-20-13-16(2)9-11-22(20)30-4/h8-13,17-18H,5-7,14H2,1-4H3,(H,25,27)(H,26,28)
InChIKeyUHMYCHSTZWCFCP-UHFFFAOYSA-N
XLogP4.70
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.51
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide with MolForge

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Related Compounds

(1S,5R)-N-(2-methoxy-5-methylphenyl)-9-oxobicyclo[3.3.1]nonane-3-carboxamide
CID 9098264
1-N-(2-methoxy-5-methylphenyl)-4-N-propan-2-ylcyclohexane-1,4-dicarboxamide
CID 109144583
1-N-cyclopropyl-4-N-(2-methoxy-5-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109144779
2-amino-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide
CID 64818120
N-(2-methoxy-5-methylphenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109131920
N-(2-methoxy-5-methylphenyl)-1-methylsulfonylpiperidine-4-carboxamide
CID 893526
4-N-(2-methoxy-5-methylphenyl)-1-N-[(4-methylphenyl)methyl]cyclohexane-1,4-dicarboxamide
CID 109148181
1-N-(4-ethylphenyl)-4-N-(2-methoxy-5-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150784
1-(benzenesulfonyl)-N-(2-methoxy-5-methylphenyl)piperidine-3-carboxamide
CID 2985320
tert-butyl 4-[(2-methoxy-5-methylphenyl)carbamoyl]piperidine-1-carboxylate
CID 29206094
N-(2-methoxy-5-methylphenyl)-4-(4-methylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
CID 109147450
1-N-(3-fluorophenyl)-4-N-(2-methoxy-5-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109151076

Frequently Asked Questions

What is the IUPAC name of 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide?
The IUPAC name of 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide (CID 60594031) is 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide.
What is the SMILES notation for 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide?
The canonical SMILES for 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide is COc1ccc(C)cc1NC(=O)C1CCCC(C(=O)Nc2cc(C)ccc2OC)C1.
What is the InChIKey of 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide?
The InChIKey is UHMYCHSTZWCFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O4/c1-15-8-10-21(29-3)19(12-15)25-23(27)17-6-5-7-18(14-17)24(28)26-20-13-16(2)9-11-22(20)30-4/h8-13,17-18H,5-7,14H2,1-4H3,(H,25,27)(H,26,28).
What are the key properties of 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide?
1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide has a molecular weight of 410.51 g/mol, XLogP of 4.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide is sourced from PubChem (CID 60594031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).