CID 59448670

C9H12N2 — CID 59448670

IUPAC—
SMILES[CH]N(C)N(C)c1ccccc1
InChIInChI=1S/C9H12N2/c1-10(2)11(3)9-7-5-4-6-8-9/h1,4-8H,2-3H3
InChIKeyPOLLUPNYZOMEDF-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.64
Rot. Bonds2

About CID 59448670

CID 59448670 (PubChem CID 59448670) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol.

Molecular Properties

Compound NameCID 59448670
PubChem CID59448670
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name—
SMILES[CH]N(C)N(C)c1ccccc1
InChIInChI=1S/C9H12N2/c1-10(2)11(3)9-7-5-4-6-8-9/h1,4-8H,2-3H3
InChIKeyPOLLUPNYZOMEDF-UHFFFAOYSA-N
XLogP1.64
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-1-phenyl-2,2-disilylhydrazine
CID 123916482
(N-methylanilino)phosphanium
CID 163691673
N,N-dimethylaniline
CID 70392672
N,N-dimethylaniline;mercury
CID 158660084
N,N-dimethylaniline;hydrofluoride
CID 160775229
N,N-dimethylaniline;hydron
CID 174471199
N,N-dimethylaniline;nickel
CID 158294400
N,N-dimethylaniline;osmium(4+)
CID 172845967
ethane;bis(N-methyl-N-phenylaniline)
CID 160716887
CID 69241188
CID 69241188
ethene;N-methyl-N-phenylaniline
CID 144541479
N,N-dimethylaniline;methanol
CID 143205399

Frequently Asked Questions

What is the IUPAC name of CID 59448670?
The IUPAC name of CID 59448670 (CID 59448670) is not available.
What is the SMILES notation for CID 59448670?
The canonical SMILES for CID 59448670 is [CH]N(C)N(C)c1ccccc1.
What is the InChIKey of CID 59448670?
The InChIKey is POLLUPNYZOMEDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-10(2)11(3)9-7-5-4-6-8-9/h1,4-8H,2-3H3.
What are the key properties of CID 59448670?
CID 59448670 has a molecular weight of 148.21 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59448670 is sourced from PubChem (CID 59448670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).