ethane;methylphosphane;N,N,2-trimethylaniline

C12H24NP — CID 162765401

IUPACethane;methylphosphane;N,N,2-trimethylaniline
SMILESCC.CP.Cc1ccccc1N(C)C
InChIInChI=1S/C9H13N.C2H6.CH5P/c1-8-6-4-5-7-9(8)10(2)3;2*1-2/h4-7H,1-3H3;1-2H3;2H2,1H3
InChIKeyVQNMCNIIHAQSBC-UHFFFAOYSA-N
MW213.30 g/mol
LogP3.58
Rot. Bonds1

About ethane;methylphosphane;N,N,2-trimethylaniline

ethane;methylphosphane;N,N,2-trimethylaniline (PubChem CID 162765401) has the molecular formula C12H24NP and a molecular weight of 213.30 g/mol. Its IUPAC name is ethane;methylphosphane;N,N,2-trimethylaniline.

Molecular Properties

Compound Nameethane;methylphosphane;N,N,2-trimethylaniline
PubChem CID162765401
Molecular FormulaC12H24NP
Molecular Weight213.30 g/mol
Exact Mass213.16
IUPAC Nameethane;methylphosphane;N,N,2-trimethylaniline
SMILESCC.CP.Cc1ccccc1N(C)C
InChIInChI=1S/C9H13N.C2H6.CH5P/c1-8-6-4-5-7-9(8)10(2)3;2*1-2/h4-7H,1-3H3;1-2H3;2H2,1H3
InChIKeyVQNMCNIIHAQSBC-UHFFFAOYSA-N
XLogP3.58
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-N-(2-methylphenyl)-N-phosphanylaniline
CID 158300974
1,1,2-trimethyl-2-(2-methylphenyl)hydrazine;hydrochloride
CID 117067186
N,10-dimethyl-N-phenylcyclodeca-1,3,5,7,9-pentaen-1-amine
CID 135227535
1,2-dimethyl-1-(2-methylphenyl)hydrazine;ethane;propane
CID 176660068
1-N-(2,6-dimethylphenyl)-2-N,2-N-dimethylbenzene-1,2-diamine
CID 23597994
N,2-dimethyl-N-propylaniline
CID 69435269
2-methyl-N,N-bis(trimethylsilyl)aniline
CID 22924503
ethane;1,2-xylene;dihydrochloride
CID 174677530
ethane;methane;pentakis(1,2-xylene)
CID 158909718
N-methyl-N-(2-methylphenyl)carbamate
CID 21115000
N,2,3,5,6-pentamethyl-N-(2-methylphenyl)aniline
CID 163538008
1,2-xylene
CID 173422016

Frequently Asked Questions

What is the IUPAC name of ethane;methylphosphane;N,N,2-trimethylaniline?
The IUPAC name of ethane;methylphosphane;N,N,2-trimethylaniline (CID 162765401) is ethane;methylphosphane;N,N,2-trimethylaniline.
What is the SMILES notation for ethane;methylphosphane;N,N,2-trimethylaniline?
The canonical SMILES for ethane;methylphosphane;N,N,2-trimethylaniline is CC.CP.Cc1ccccc1N(C)C.
What is the InChIKey of ethane;methylphosphane;N,N,2-trimethylaniline?
The InChIKey is VQNMCNIIHAQSBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N.C2H6.CH5P/c1-8-6-4-5-7-9(8)10(2)3;2*1-2/h4-7H,1-3H3;1-2H3;2H2,1H3.
What are the key properties of ethane;methylphosphane;N,N,2-trimethylaniline?
ethane;methylphosphane;N,N,2-trimethylaniline has a molecular weight of 213.30 g/mol, XLogP of 3.58, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methylphosphane;N,N,2-trimethylaniline is sourced from PubChem (CID 162765401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).