4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide

C12H24N2 — CID 65392128

IUPAC4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide
SMILESCCC1CCC(/C(N)=N/C(C)C)CC1
InChIInChI=1S/C12H24N2/c1-4-10-5-7-11(8-6-10)12(13)14-9(2)3/h9-11H,4-8H2,1-3H3,(H2,13,14)
InChIKeyNGOCKNSAHLNONT-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.97
Rot. Bonds3

About 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide

4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide (PubChem CID 65392128) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide.

Molecular Properties

Compound Name4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide
PubChem CID65392128
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide
SMILESCCC1CCC(/C(N)=N/C(C)C)CC1
InChIInChI=1S/C12H24N2/c1-4-10-5-7-11(8-6-10)12(13)14-9(2)3/h9-11H,4-8H2,1-3H3,(H2,13,14)
InChIKeyNGOCKNSAHLNONT-UHFFFAOYSA-N
XLogP2.97
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide?
The IUPAC name of 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide (CID 65392128) is 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide.
What is the SMILES notation for 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide?
The canonical SMILES for 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide is CCC1CCC(/C(N)=N/C(C)C)CC1.
What is the InChIKey of 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide?
The InChIKey is NGOCKNSAHLNONT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-4-10-5-7-11(8-6-10)12(13)14-9(2)3/h9-11H,4-8H2,1-3H3,(H2,13,14).
What are the key properties of 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide?
4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide has a molecular weight of 196.34 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide is sourced from PubChem (CID 65392128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).