2-(methylamino)cyclohexane-1-carboxamide

C8H16N2O — CID 72740884

IUPAC2-(methylamino)cyclohexane-1-carboxamide
SMILESCNC1CCCCC1C(N)=O
InChIInChI=1S/C8H16N2O/c1-10-7-5-3-2-4-6(7)8(9)11/h6-7,10H,2-5H2,1H3,(H2,9,11)
InChIKeyHYXNUCJQDGCKCW-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.25
Rot. Bonds2

About 2-(methylamino)cyclohexane-1-carboxamide

2-(methylamino)cyclohexane-1-carboxamide (PubChem CID 72740884) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-(methylamino)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-(methylamino)cyclohexane-1-carboxamide
PubChem CID72740884
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-(methylamino)cyclohexane-1-carboxamide
SMILESCNC1CCCCC1C(N)=O
InChIInChI=1S/C8H16N2O/c1-10-7-5-3-2-4-6(7)8(9)11/h6-7,10H,2-5H2,1H3,(H2,9,11)
InChIKeyHYXNUCJQDGCKCW-UHFFFAOYSA-N
XLogP0.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)cyclohexane-1-carboxamide?
The IUPAC name of 2-(methylamino)cyclohexane-1-carboxamide (CID 72740884) is 2-(methylamino)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-(methylamino)cyclohexane-1-carboxamide?
The canonical SMILES for 2-(methylamino)cyclohexane-1-carboxamide is CNC1CCCCC1C(N)=O.
What is the InChIKey of 2-(methylamino)cyclohexane-1-carboxamide?
The InChIKey is HYXNUCJQDGCKCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-10-7-5-3-2-4-6(7)8(9)11/h6-7,10H,2-5H2,1H3,(H2,9,11).
What are the key properties of 2-(methylamino)cyclohexane-1-carboxamide?
2-(methylamino)cyclohexane-1-carboxamide has a molecular weight of 156.23 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)cyclohexane-1-carboxamide is sourced from PubChem (CID 72740884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).