N-(cycloheptylideneamino)methanamine

C8H16N2 — CID 12674853

IUPACN-(cycloheptylideneamino)methanamine
SMILESCNN=C1CCCCCC1
InChIInChI=1S/C8H16N2/c1-9-10-8-6-4-2-3-5-7-8/h9H,2-7H2,1H3
InChIKeyMEOUGULQOOJPCT-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.92
Rot. Bonds1

About N-(cycloheptylideneamino)methanamine

N-(cycloheptylideneamino)methanamine (PubChem CID 12674853) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N-(cycloheptylideneamino)methanamine.

Molecular Properties

Compound NameN-(cycloheptylideneamino)methanamine
PubChem CID12674853
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN-(cycloheptylideneamino)methanamine
SMILESCNN=C1CCCCCC1
InChIInChI=1S/C8H16N2/c1-9-10-8-6-4-2-3-5-7-8/h9H,2-7H2,1H3
InChIKeyMEOUGULQOOJPCT-UHFFFAOYSA-N
XLogP1.92
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(cycloheptylideneamino)methanamine?
The IUPAC name of N-(cycloheptylideneamino)methanamine (CID 12674853) is N-(cycloheptylideneamino)methanamine.
What is the SMILES notation for N-(cycloheptylideneamino)methanamine?
The canonical SMILES for N-(cycloheptylideneamino)methanamine is CNN=C1CCCCCC1.
What is the InChIKey of N-(cycloheptylideneamino)methanamine?
The InChIKey is MEOUGULQOOJPCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-9-10-8-6-4-2-3-5-7-8/h9H,2-7H2,1H3.
What are the key properties of N-(cycloheptylideneamino)methanamine?
N-(cycloheptylideneamino)methanamine has a molecular weight of 140.23 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cycloheptylideneamino)methanamine is sourced from PubChem (CID 12674853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).