N'-(4-ethylcyclohexyl)propanimidamide

C11H22N2 — CID 63176970

IUPACN'-(4-ethylcyclohexyl)propanimidamide
SMILESCC/C(N)=N\C1CCC(CC)CC1
InChIInChI=1S/C11H22N2/c1-3-9-5-7-10(8-6-9)13-11(12)4-2/h9-10H,3-8H2,1-2H3,(H2,12,13)
InChIKeyYLETZYCULKQYJV-UHFFFAOYSA-N
MW182.31 g/mol
LogP2.72
Rot. Bonds3

About N'-(4-ethylcyclohexyl)propanimidamide

N'-(4-ethylcyclohexyl)propanimidamide (PubChem CID 63176970) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N'-(4-ethylcyclohexyl)propanimidamide.

Molecular Properties

Compound NameN'-(4-ethylcyclohexyl)propanimidamide
PubChem CID63176970
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN'-(4-ethylcyclohexyl)propanimidamide
SMILESCC/C(N)=N\C1CCC(CC)CC1
InChIInChI=1S/C11H22N2/c1-3-9-5-7-10(8-6-9)13-11(12)4-2/h9-10H,3-8H2,1-2H3,(H2,12,13)
InChIKeyYLETZYCULKQYJV-UHFFFAOYSA-N
XLogP2.72
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.72
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

N'-(4-methylcyclohexyl)propanimidamide
CID 62049807
N'-cyclopropylpentanimidamide
CID 79413074
4-ethylcyclohexane-1-carbothioamide
CID 64749084
N'-(2-ethylcyclopentyl)propanimidamide
CID 130778450
ethanamine;ethylcyclopropane
CID 70018487
N'-(4-propylcyclohexyl)ethanimidamide
CID 63173139
azane;ethylcyclopropane
CID 20975579
ethane;ethylcyclopropane
CID 91380076
4-ethyl-N'-propan-2-ylcyclohexane-1-carboximidamide
CID 65392128
N'-[(3-methylcyclopentyl)methyl]propanimidamide
CID 107415433
N'-cyclopropyl-2-methylsulfonylethanimidamide
CID 63182120
2-[(4-ethylcyclohexyl)amino]-N'-hydroxyethanimidamide
CID 77030799

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethylcyclohexyl)propanimidamide?
The IUPAC name of N'-(4-ethylcyclohexyl)propanimidamide (CID 63176970) is N'-(4-ethylcyclohexyl)propanimidamide.
What is the SMILES notation for N'-(4-ethylcyclohexyl)propanimidamide?
The canonical SMILES for N'-(4-ethylcyclohexyl)propanimidamide is CC/C(N)=N\C1CCC(CC)CC1.
What is the InChIKey of N'-(4-ethylcyclohexyl)propanimidamide?
The InChIKey is YLETZYCULKQYJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-3-9-5-7-10(8-6-9)13-11(12)4-2/h9-10H,3-8H2,1-2H3,(H2,12,13).
What are the key properties of N'-(4-ethylcyclohexyl)propanimidamide?
N'-(4-ethylcyclohexyl)propanimidamide has a molecular weight of 182.31 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethylcyclohexyl)propanimidamide is sourced from PubChem (CID 63176970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).