2-cyclohexyl-N'-methylethanimidamide

C9H18N2 — CID 130678198

IUPAC2-cyclohexyl-N'-methylethanimidamide
SMILESC/N=C(\N)CC1CCCCC1
InChIInChI=1S/C9H18N2/c1-11-9(10)7-8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,10,11)
InChIKeyBKMWBSKCJARMCX-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.94
Rot. Bonds2

About 2-cyclohexyl-N'-methylethanimidamide

2-cyclohexyl-N'-methylethanimidamide (PubChem CID 130678198) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2-cyclohexyl-N'-methylethanimidamide.

Molecular Properties

Compound Name2-cyclohexyl-N'-methylethanimidamide
PubChem CID130678198
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2-cyclohexyl-N'-methylethanimidamide
SMILESC/N=C(\N)CC1CCCCC1
InChIInChI=1S/C9H18N2/c1-11-9(10)7-8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,10,11)
InChIKeyBKMWBSKCJARMCX-UHFFFAOYSA-N
XLogP1.94
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.94
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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Related Compounds

2-cyclopropyl-N'-methylethanimidamide;hydrochloride
CID 146049492
2-cyclodecylacetamide
CID 150110792
2-cyclohexylethanethioamide
CID 18755158
cyclohexylmethyl N'-methylcarbamimidothioate
CID 130719804
2-cyclobutyl-N'-ethenylethanimidamide
CID 146321464
2-cyclohexylacetic acid;ethane;methanamine
CID 176577797
1-cyclohexadecylpropan-2-one
CID 175123721
2-[(N'-cyclohexylcarbamimidoyl)amino]-N'-methylethanimidamide
CID 176523293
N-but-3-yn-2-ylidene-2-cyclohexyl-N'-methylethanimidamide
CID 145208528
cyclohexylmethanamine;methanol
CID 70430105
N-(1-cyclopentylpropan-2-ylidene)hydroxylamine
CID 131143406
3-(cyclohexylmethylamino)-N'-hydroxypropanimidamide
CID 77028587

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N'-methylethanimidamide?
The IUPAC name of 2-cyclohexyl-N'-methylethanimidamide (CID 130678198) is 2-cyclohexyl-N'-methylethanimidamide.
What is the SMILES notation for 2-cyclohexyl-N'-methylethanimidamide?
The canonical SMILES for 2-cyclohexyl-N'-methylethanimidamide is C/N=C(\N)CC1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N'-methylethanimidamide?
The InChIKey is BKMWBSKCJARMCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-11-9(10)7-8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,10,11).
What are the key properties of 2-cyclohexyl-N'-methylethanimidamide?
2-cyclohexyl-N'-methylethanimidamide has a molecular weight of 154.26 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N'-methylethanimidamide is sourced from PubChem (CID 130678198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).