N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide

C24H44N2O2 — CID 146527728

IUPACN-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide
SMILESCC1CCC(NC(=O)C2CCC(COCC3CC(C)(C)NC3(C)C)CC2)CC1
InChIInChI=1S/C24H44N2O2/c1-17-6-12-21(13-7-17)25-22(27)19-10-8-18(9-11-19)15-28-16-20-14-23(2,3)26-24(20,4)5/h17-21,26H,6-16H2,1-5H3,(H,25,27)
InChIKeyAMQNHFRKPXZYCD-UHFFFAOYSA-N
MW392.63 g/mol
LogP4.67
Rot. Bonds6

About N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide

N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide (PubChem CID 146527728) has the molecular formula C24H44N2O2 and a molecular weight of 392.63 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide
PubChem CID146527728
Molecular FormulaC24H44N2O2
Molecular Weight392.63 g/mol
Exact Mass392.34
IUPAC NameN-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide
SMILESCC1CCC(NC(=O)C2CCC(COCC3CC(C)(C)NC3(C)C)CC2)CC1
InChIInChI=1S/C24H44N2O2/c1-17-6-12-21(13-7-17)25-22(27)19-10-8-18(9-11-19)15-28-16-20-14-23(2,3)26-24(20,4)5/h17-21,26H,6-16H2,1-5H3,(H,25,27)
InChIKeyAMQNHFRKPXZYCD-UHFFFAOYSA-N
XLogP4.67
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.63
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide with MolForge

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Related Compounds

[4-[(4-methylcyclohexyl)carbamoyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate
CID 146527730
bis[(2,2,5,5-tetramethylpyrrolidin-3-yl)methyl] cyclohexane-1,4-dicarboxylate
CID 138723963
N-(4,4-dimethylcyclohexyl)-4-methylcyclohexane-1-carboxamide
CID 141160516
N-(2,2,6,6-tetramethylpiperidin-4-yl)cyclopentanecarboxamide
CID 14697374
2,2,5,5-tetramethyl-3-(propoxymethyl)pyrrolidine
CID 145268424
N-cyclohexyl-2,2,6,6-tetramethylpiperidine-4-carboxamide
CID 90092330
N-(3,3,5,5-tetramethylcyclohexyl)cyclopropanecarboxamide
CID 112568442
(2,2,5,5-tetramethylpyrrolidin-3-yl)methyl nitrate
CID 141421485
N-(1-formylpiperidin-4-yl)-4-methylcyclohexane-1-carboxamide
CID 141160513
ethyl 2-[4-(cyclopropanecarbonylamino)cyclohexyl]acetate
CID 121439164
methyl 4-(cyclopropanecarbonylamino)cyclohexane-1-carboxylate
CID 115617179
4-N-cyclopropyl-1-N-propylcyclohexane-1,4-dicarboxamide
CID 109144255

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide?
The IUPAC name of N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide (CID 146527728) is N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide?
The canonical SMILES for N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide is CC1CCC(NC(=O)C2CCC(COCC3CC(C)(C)NC3(C)C)CC2)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide?
The InChIKey is AMQNHFRKPXZYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H44N2O2/c1-17-6-12-21(13-7-17)25-22(27)19-10-8-18(9-11-19)15-28-16-20-14-23(2,3)26-24(20,4)5/h17-21,26H,6-16H2,1-5H3,(H,25,27).
What are the key properties of N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide?
N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide has a molecular weight of 392.63 g/mol, XLogP of 4.67, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 146527728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).