N'-(4-propylcyclohexyl)cyclohexanecarboximidamide

C16H30N2 — CID 63529179

IUPACN'-(4-propylcyclohexyl)cyclohexanecarboximidamide
SMILESCCCC1CCC(/N=C(\N)C2CCCCC2)CC1
InChIInChI=1S/C16H30N2/c1-2-6-13-9-11-15(12-10-13)18-16(17)14-7-4-3-5-8-14/h13-15H,2-12H2,1H3,(H2,17,18)
InChIKeyVVCGNVJXIFWGQI-UHFFFAOYSA-N
MW250.43 g/mol
LogP4.28
Rot. Bonds4

About N'-(4-propylcyclohexyl)cyclohexanecarboximidamide

N'-(4-propylcyclohexyl)cyclohexanecarboximidamide (PubChem CID 63529179) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is N'-(4-propylcyclohexyl)cyclohexanecarboximidamide.

Molecular Properties

Compound NameN'-(4-propylcyclohexyl)cyclohexanecarboximidamide
PubChem CID63529179
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC NameN'-(4-propylcyclohexyl)cyclohexanecarboximidamide
SMILESCCCC1CCC(/N=C(\N)C2CCCCC2)CC1
InChIInChI=1S/C16H30N2/c1-2-6-13-9-11-15(12-10-13)18-16(17)14-7-4-3-5-8-14/h13-15H,2-12H2,1H3,(H2,17,18)
InChIKeyVVCGNVJXIFWGQI-UHFFFAOYSA-N
XLogP4.28
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 54.28
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-propylcyclohexyl)ethanimidamide
CID 63173139
N'-amino-4-propylcyclohexane-1-carboximidamide
CID 77067351
N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide
CID 65402208
N'-cyclopentyl-4-propylpiperidine-1-carboximidamide
CID 55063728
1-(2-cyclohexylethyl)-4-[2-(4-propylcyclohexyl)ethyl]cyclohexane
CID 70430254
propylcyclotetradecane
CID 90991550
4-propylcyclononane-1-carboxylic acid
CID 123911377
N'-(2-methylcyclopropyl)cyclohexanecarboximidamide
CID 63178369
1-butyl-4-propylcyclononane
CID 123467552
1-cyclohexyl-6-propylcyclodecane
CID 58552139
formaldehyde;propylcyclohexane
CID 174845889
formonitrile;propylcyclohexane
CID 174902049

Frequently Asked Questions

What is the IUPAC name of N'-(4-propylcyclohexyl)cyclohexanecarboximidamide?
The IUPAC name of N'-(4-propylcyclohexyl)cyclohexanecarboximidamide (CID 63529179) is N'-(4-propylcyclohexyl)cyclohexanecarboximidamide.
What is the SMILES notation for N'-(4-propylcyclohexyl)cyclohexanecarboximidamide?
The canonical SMILES for N'-(4-propylcyclohexyl)cyclohexanecarboximidamide is CCCC1CCC(/N=C(\N)C2CCCCC2)CC1.
What is the InChIKey of N'-(4-propylcyclohexyl)cyclohexanecarboximidamide?
The InChIKey is VVCGNVJXIFWGQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-2-6-13-9-11-15(12-10-13)18-16(17)14-7-4-3-5-8-14/h13-15H,2-12H2,1H3,(H2,17,18).
What are the key properties of N'-(4-propylcyclohexyl)cyclohexanecarboximidamide?
N'-(4-propylcyclohexyl)cyclohexanecarboximidamide has a molecular weight of 250.43 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-propylcyclohexyl)cyclohexanecarboximidamide is sourced from PubChem (CID 63529179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).