CID 102142484

C13H14N2+ — CID 102142484

IUPAC—
SMILES[CH2]CN(c1ccccc1)c1cc[nH+]cc1
InChIInChI=1S/C13H13N2/c1-2-15(12-6-4-3-5-7-12)13-8-10-14-11-9-13/h3-11H,1-2H2/p+1
InChIKeyKSLMBNWEJYFDIO-UHFFFAOYSA-O
MW198.27 g/mol
LogP2.47
Rot. Bonds3

About CID 102142484

CID 102142484 (PubChem CID 102142484) has the molecular formula C13H14N2+ and a molecular weight of 198.27 g/mol.

Molecular Properties

Compound NameCID 102142484
PubChem CID102142484
Molecular FormulaC13H14N2+
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name—
SMILES[CH2]CN(c1ccccc1)c1cc[nH+]cc1
InChIInChI=1S/C13H13N2/c1-2-15(12-6-4-3-5-7-12)13-8-10-14-11-9-13/h3-11H,1-2H2/p+1
InChIKeyKSLMBNWEJYFDIO-UHFFFAOYSA-O
XLogP2.47
TPSA17.38 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(iodomethyl)-N-phenylaniline
CID 59863595
lithium;hydride;N-phenyl-N-prop-2-enylaniline
CID 174146477
N-(8-chlorooctyl)-N-phenylaniline
CID 10852868
N-(2,2-difluoroethyl)-N-phenylaniline
CID 10399080
4-[(3S,4R,7R,8S)-4,8-diphenyl-7-pyridin-1-ium-4-yl-3-tricyclo[4.2.0.02,5]octanyl]pyridin-1-ium
CID 102308578
N,N-diphenylaniline;ethene
CID 135186601
butane;N-octyl-N-phenylaniline
CID 175431375
4-[N-[2-(N-(4-hydroxyphenyl)anilino)ethyl]anilino]phenol
CID 58759192
N-phenyl-N-[2-[1-(N-phenylanilino)but-3-en-2-yloxy]but-3-enyl]aniline
CID 57169544
N-butyl-N-phenylaniline;hydrobromide
CID 70419495
N,N-bis(prop-2-enylamino)aniline
CID 70255939
[(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium
CID 7337949

Frequently Asked Questions

What is the IUPAC name of CID 102142484?
The IUPAC name of CID 102142484 (CID 102142484) is not available.
What is the SMILES notation for CID 102142484?
The canonical SMILES for CID 102142484 is [CH2]CN(c1ccccc1)c1cc[nH+]cc1.
What is the InChIKey of CID 102142484?
The InChIKey is KSLMBNWEJYFDIO-UHFFFAOYSA-O. The full InChI is InChI=1S/C13H13N2/c1-2-15(12-6-4-3-5-7-12)13-8-10-14-11-9-13/h3-11H,1-2H2/p+1.
What are the key properties of CID 102142484?
CID 102142484 has a molecular weight of 198.27 g/mol, XLogP of 2.47, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102142484 is sourced from PubChem (CID 102142484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).