N,N-dicyclohexylethanimidamide

C14H26N2 — CID 53437350

IUPACN,N-dicyclohexylethanimidamide
SMILES[H]/N=C(\C)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C14H26N2/c1-12(15)16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h13-15H,2-11H2,1H3/b15-12+
InChIKeyOTCZVWNTUVWFSL-NTCAYCPXSA-N
MW222.38 g/mol
LogP3.95
Rot. Bonds2

About N,N-dicyclohexylethanimidamide

N,N-dicyclohexylethanimidamide (PubChem CID 53437350) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N,N-dicyclohexylethanimidamide.

Molecular Properties

Compound NameN,N-dicyclohexylethanimidamide
PubChem CID53437350
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN,N-dicyclohexylethanimidamide
SMILES[H]/N=C(\C)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C14H26N2/c1-12(15)16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h13-15H,2-11H2,1H3/b15-12+
InChIKeyOTCZVWNTUVWFSL-NTCAYCPXSA-N
XLogP3.95
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 53.95
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'}

Analyze N,N-dicyclohexylethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexylethanimidamide?
The IUPAC name of N,N-dicyclohexylethanimidamide (CID 53437350) is N,N-dicyclohexylethanimidamide.
What is the SMILES notation for N,N-dicyclohexylethanimidamide?
The canonical SMILES for N,N-dicyclohexylethanimidamide is [H]/N=C(\C)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,N-dicyclohexylethanimidamide?
The InChIKey is OTCZVWNTUVWFSL-NTCAYCPXSA-N. The full InChI is InChI=1S/C14H26N2/c1-12(15)16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h13-15H,2-11H2,1H3/b15-12+.
What are the key properties of N,N-dicyclohexylethanimidamide?
N,N-dicyclohexylethanimidamide has a molecular weight of 222.38 g/mol, XLogP of 3.95, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexylethanimidamide is sourced from PubChem (CID 53437350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).