N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline

C19H26NP — CID 58961695

IUPACN-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline
SMILESCPc1ccccc1Nc1c(C(C)C)cccc1C(C)C
InChIInChI=1S/C19H26NP/c1-13(2)15-9-8-10-16(14(3)4)19(15)20-17-11-6-7-12-18(17)21-5/h6-14,20-21H,1-5H3
InChIKeyNLPQRLVPQLQQTA-UHFFFAOYSA-N
MW299.40 g/mol
LogP5.61
Rot. Bonds5

About N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline

N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline (PubChem CID 58961695) has the molecular formula C19H26NP and a molecular weight of 299.40 g/mol. Its IUPAC name is N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline.

Molecular Properties

Compound NameN-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline
PubChem CID58961695
Molecular FormulaC19H26NP
Molecular Weight299.40 g/mol
Exact Mass299.18
IUPAC NameN-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline
SMILESCPc1ccccc1Nc1c(C(C)C)cccc1C(C)C
InChIInChI=1S/C19H26NP/c1-13(2)15-9-8-10-16(14(3)4)19(15)20-17-11-6-7-12-18(17)21-5/h6-14,20-21H,1-5H3
InChIKeyNLPQRLVPQLQQTA-UHFFFAOYSA-N
XLogP5.61
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.40
LogP ≤ 55.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N-[2,6-di(propan-2-yl)phenyl]-1-N-(2-phenylsulfanylphenyl)benzene-1,2-diamine
CID 141233352
N-(2-methanimidoylphenyl)-2,6-di(propan-2-yl)aniline
CID 87946949
2,4,6-trimethyl-N-(2-propan-2-ylphenyl)aniline
CID 129025660
1-N-phenyl-4-N-(2-propan-2-ylphenyl)benzene-1,4-diamine
CID 141333643
N-[2-[[4-[2-[4-[[2-[2,6-di(propan-2-yl)anilino]phenyl]methylideneamino]-3,5-dimethylphenyl]phenyl]-2,6-dimethylphenyl]iminomethyl]phenyl]-2,6-di(propan-2-yl)aniline
CID 11286257
N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt
CID 175492359
2-N-[2,6-di(propan-2-yl)phenyl]-3-N-[2,4,6-tri(propan-2-yl)phenyl]pyridine-2,3-diamine
CID 168763290
N-[2,6-di(propan-2-yl)phenyl]benzo[h]quinolin-10-amine
CID 153406520
N-[2-[2-(dimethylamino)ethyliminomethyl]phenyl]-2,6-di(propan-2-yl)aniline
CID 102262356
2-methyl-N-[2-(2-methylpropylphosphanyl)phenyl]aniline
CID 134572435
N-(4-chlorophenyl)-2-propan-2-ylaniline
CID 82536589
2-methylphosphanyl-3-propan-2-ylanthracene-9,10-dione
CID 90900805

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline?
The IUPAC name of N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline (CID 58961695) is N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline.
What is the SMILES notation for N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline?
The canonical SMILES for N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline is CPc1ccccc1Nc1c(C(C)C)cccc1C(C)C.
What is the InChIKey of N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline?
The InChIKey is NLPQRLVPQLQQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26NP/c1-13(2)15-9-8-10-16(14(3)4)19(15)20-17-11-6-7-12-18(17)21-5/h6-14,20-21H,1-5H3.
What are the key properties of N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline?
N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline has a molecular weight of 299.40 g/mol, XLogP of 5.61, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline is sourced from PubChem (CID 58961695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).