N-(cyclohexylidenemethyl)propan-1-imine

C10H17N — CID 12942395

IUPACN-(cyclohexylidenemethyl)propan-1-imine
SMILESCC/C=N/C=C1CCCCC1
InChIInChI=1S/C10H17N/c1-2-8-11-9-10-6-4-3-5-7-10/h8-9H,2-7H2,1H3/b11-8+
InChIKeyKVWNCESUUZYUNL-DHZHZOJOSA-N
MW151.25 g/mol
LogP3.32
Rot. Bonds2

About N-(cyclohexylidenemethyl)propan-1-imine

N-(cyclohexylidenemethyl)propan-1-imine (PubChem CID 12942395) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N-(cyclohexylidenemethyl)propan-1-imine.

Molecular Properties

Compound NameN-(cyclohexylidenemethyl)propan-1-imine
PubChem CID12942395
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN-(cyclohexylidenemethyl)propan-1-imine
SMILESCC/C=N/C=C1CCCCC1
InChIInChI=1S/C10H17N/c1-2-8-11-9-10-6-4-3-5-7-10/h8-9H,2-7H2,1H3/b11-8+
InChIKeyKVWNCESUUZYUNL-DHZHZOJOSA-N
XLogP3.32
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylidenemethyl)propan-1-imine?
The IUPAC name of N-(cyclohexylidenemethyl)propan-1-imine (CID 12942395) is N-(cyclohexylidenemethyl)propan-1-imine.
What is the SMILES notation for N-(cyclohexylidenemethyl)propan-1-imine?
The canonical SMILES for N-(cyclohexylidenemethyl)propan-1-imine is CC/C=N/C=C1CCCCC1.
What is the InChIKey of N-(cyclohexylidenemethyl)propan-1-imine?
The InChIKey is KVWNCESUUZYUNL-DHZHZOJOSA-N. The full InChI is InChI=1S/C10H17N/c1-2-8-11-9-10-6-4-3-5-7-10/h8-9H,2-7H2,1H3/b11-8+.
What are the key properties of N-(cyclohexylidenemethyl)propan-1-imine?
N-(cyclohexylidenemethyl)propan-1-imine has a molecular weight of 151.25 g/mol, XLogP of 3.32, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylidenemethyl)propan-1-imine is sourced from PubChem (CID 12942395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).