N-methyl-N-propan-2-ylcyclohexanecarboxamide

C11H21NO — CID 58372792

IUPACN-methyl-N-propan-2-ylcyclohexanecarboxamide
SMILESCC(C)N(C)C(=O)C1CCCCC1
InChIInChI=1S/C11H21NO/c1-9(2)12(3)11(13)10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3
InChIKeyAAGKBIZKEJRNMB-UHFFFAOYSA-N
MW183.30 g/mol
LogP2.43
Rot. Bonds2

About N-methyl-N-propan-2-ylcyclohexanecarboxamide

N-methyl-N-propan-2-ylcyclohexanecarboxamide (PubChem CID 58372792) has the molecular formula C11H21NO and a molecular weight of 183.30 g/mol. Its IUPAC name is N-methyl-N-propan-2-ylcyclohexanecarboxamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-ylcyclohexanecarboxamide
PubChem CID58372792
Molecular FormulaC11H21NO
Molecular Weight183.30 g/mol
Exact Mass183.16
IUPAC NameN-methyl-N-propan-2-ylcyclohexanecarboxamide
SMILESCC(C)N(C)C(=O)C1CCCCC1
InChIInChI=1S/C11H21NO/c1-9(2)12(3)11(13)10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3
InChIKeyAAGKBIZKEJRNMB-UHFFFAOYSA-N
XLogP2.43
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-ylcyclohexanecarboxamide?
The IUPAC name of N-methyl-N-propan-2-ylcyclohexanecarboxamide (CID 58372792) is N-methyl-N-propan-2-ylcyclohexanecarboxamide.
What is the SMILES notation for N-methyl-N-propan-2-ylcyclohexanecarboxamide?
The canonical SMILES for N-methyl-N-propan-2-ylcyclohexanecarboxamide is CC(C)N(C)C(=O)C1CCCCC1.
What is the InChIKey of N-methyl-N-propan-2-ylcyclohexanecarboxamide?
The InChIKey is AAGKBIZKEJRNMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(2)12(3)11(13)10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3.
What are the key properties of N-methyl-N-propan-2-ylcyclohexanecarboxamide?
N-methyl-N-propan-2-ylcyclohexanecarboxamide has a molecular weight of 183.30 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-ylcyclohexanecarboxamide is sourced from PubChem (CID 58372792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).