CID 139242688

C9H12N2 — CID 139242688

IUPAC—
SMILESCN1[C]N(C)/C=C\C=C/C=C\1
InChIInChI=1S/C9H12N2/c1-10-7-5-3-4-6-8-11(2)9-10/h3-8H,1-2H3/b4-3-,7-5-,8-6-
InChIKeyMODWNGWAIUUSJH-RWPVZYMPSA-N
MW148.21 g/mol
LogP1.44
Rot. Bonds

About CID 139242688

CID 139242688 (PubChem CID 139242688) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol.

Molecular Properties

Compound NameCID 139242688
PubChem CID139242688
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name—
SMILESCN1[C]N(C)/C=C\C=C/C=C\1
InChIInChI=1S/C9H12N2/c1-10-7-5-3-4-6-8-11(2)9-10/h3-8H,1-2H3/b4-3-,7-5-,8-6-
InChIKeyMODWNGWAIUUSJH-RWPVZYMPSA-N
XLogP1.44
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 139242688?
The IUPAC name of CID 139242688 (CID 139242688) is not available.
What is the SMILES notation for CID 139242688?
The canonical SMILES for CID 139242688 is CN1[C]N(C)/C=C\C=C/C=C\1.
What is the InChIKey of CID 139242688?
The InChIKey is MODWNGWAIUUSJH-RWPVZYMPSA-N. The full InChI is InChI=1S/C9H12N2/c1-10-7-5-3-4-6-8-11(2)9-10/h3-8H,1-2H3/b4-3-,7-5-,8-6-.
What are the key properties of CID 139242688?
CID 139242688 has a molecular weight of 148.21 g/mol, XLogP of 1.44, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 139242688 is sourced from PubChem (CID 139242688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).