N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide

C22H38N2O2 — CID 2933083

IUPACN-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide
SMILESCC1(C)CC(NC(=O)C2CCCC2)CC(C)(CNC(=O)C2CCCC2)C1
InChIInChI=1S/C22H38N2O2/c1-21(2)12-18(24-20(26)17-10-6-7-11-17)13-22(3,14-21)15-23-19(25)16-8-4-5-9-16/h16-18H,4-15H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyRIGBHXSBRXDNOI-UHFFFAOYSA-N
MW362.56 g/mol
LogP4.18
Rot. Bonds5

About N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide

N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide (PubChem CID 2933083) has the molecular formula C22H38N2O2 and a molecular weight of 362.56 g/mol. Its IUPAC name is N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide
PubChem CID2933083
Molecular FormulaC22H38N2O2
Molecular Weight362.56 g/mol
Exact Mass362.29
IUPAC NameN-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide
SMILESCC1(C)CC(NC(=O)C2CCCC2)CC(C)(CNC(=O)C2CCCC2)C1
InChIInChI=1S/C22H38N2O2/c1-21(2)12-18(24-20(26)17-10-6-7-11-17)13-22(3,14-21)15-23-19(25)16-8-4-5-9-16/h16-18H,4-15H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyRIGBHXSBRXDNOI-UHFFFAOYSA-N
XLogP4.18
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.56
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide?
The IUPAC name of N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide (CID 2933083) is N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide?
The canonical SMILES for N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide is CC1(C)CC(NC(=O)C2CCCC2)CC(C)(CNC(=O)C2CCCC2)C1.
What is the InChIKey of N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide?
The InChIKey is RIGBHXSBRXDNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H38N2O2/c1-21(2)12-18(24-20(26)17-10-6-7-11-17)13-22(3,14-21)15-23-19(25)16-8-4-5-9-16/h16-18H,4-15H2,1-3H3,(H,23,25)(H,24,26).
What are the key properties of N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide?
N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide has a molecular weight of 362.56 g/mol, XLogP of 4.18, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(cyclopentanecarbonylamino)-1,3,3-trimethylcyclohexyl]methyl]cyclopentanecarboxamide is sourced from PubChem (CID 2933083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).