N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine

C16H20NP — CID 15446809

IUPACN,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine
SMILESCN(C)Cc1ccccc1P(C)c1ccccc1
InChIInChI=1S/C16H20NP/c1-17(2)13-14-9-7-8-12-16(14)18(3)15-10-5-4-6-11-15/h4-12H,13H2,1-3H3
InChIKeyMKTODXCDBNLKOO-UHFFFAOYSA-N
MW257.32 g/mol
LogP2.81
Rot. Bonds4

About N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine

N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine (PubChem CID 15446809) has the molecular formula C16H20NP and a molecular weight of 257.32 g/mol. Its IUPAC name is N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine
PubChem CID15446809
Molecular FormulaC16H20NP
Molecular Weight257.32 g/mol
Exact Mass257.13
IUPAC NameN,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine
SMILESCN(C)Cc1ccccc1P(C)c1ccccc1
InChIInChI=1S/C16H20NP/c1-17(2)13-14-9-7-8-12-16(14)18(3)15-10-5-4-6-11-15/h4-12H,13H2,1-3H3
InChIKeyMKTODXCDBNLKOO-UHFFFAOYSA-N
XLogP2.81
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.32
LogP ≤ 52.81
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

1-[2-[[2-[(dimethylamino)methyl]phenyl]-methylphosphanyl]phenyl]-N,N-dimethylmethanamine
CID 11050518
1-[2-[[2-[(dimethylamino)methyl]phenyl]-phenylphosphanyl]phenyl]-N,N-dimethylmethanamine
CID 15039376
1-[2-[bis(trimethylsilyl)methyl-[2-[(dimethylamino)methyl]phenyl]phosphanyl]phenyl]-N,N-dimethylmethanamine
CID 15436117
2-[methyl(phenyl)phosphanyl]phenol
CID 11820610
1-[2-[[2-[(dimethylamino)methyl]phenyl]methyl]phenyl]-N,N-dimethylmethanamine
CID 167700248
(2,3-dibutylphenyl)-methyl-phenylphosphane
CID 90110911
CID 138974220
CID 138974220
1-[2-(chloromethyl)phenyl]-N,N-dimethylmethanamine
CID 14459148
[2-[(dimethylamino)methyl]phenyl]methanamine
CID 4962718
1-(4-diphenylphosphanylphenyl)-N,N-dimethylmethanamine
CID 134068234
methyl(diphenyl)phosphane;palladium(2+);dichloride
CID 175235701
carbanide;gold(1+);methyl(diphenyl)phosphane
CID 87994939

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine?
The IUPAC name of N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine (CID 15446809) is N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine is CN(C)Cc1ccccc1P(C)c1ccccc1.
What is the InChIKey of N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine?
The InChIKey is MKTODXCDBNLKOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20NP/c1-17(2)13-14-9-7-8-12-16(14)18(3)15-10-5-4-6-11-15/h4-12H,13H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine?
N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine has a molecular weight of 257.32 g/mol, XLogP of 2.81, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[2-[methyl(phenyl)phosphanyl]phenyl]methanamine is sourced from PubChem (CID 15446809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).