4-[2-(methylamino)-1-phosphanylpropyl]aniline

C10H17N2P — CID 89327462

IUPAC4-[2-(methylamino)-1-phosphanylpropyl]aniline
SMILESCNC(C)C(P)c1ccc(N)cc1
InChIInChI=1S/C10H17N2P/c1-7(12-2)10(13)8-3-5-9(11)6-4-8/h3-7,10,12H,11,13H2,1-2H3
InChIKeyMVMFPYZNMUKYNN-UHFFFAOYSA-N
MW196.23 g/mol
LogP1.79
Rot. Bonds3

About 4-[2-(methylamino)-1-phosphanylpropyl]aniline

4-[2-(methylamino)-1-phosphanylpropyl]aniline (PubChem CID 89327462) has the molecular formula C10H17N2P and a molecular weight of 196.23 g/mol. Its IUPAC name is 4-[2-(methylamino)-1-phosphanylpropyl]aniline.

Molecular Properties

Compound Name4-[2-(methylamino)-1-phosphanylpropyl]aniline
PubChem CID89327462
Molecular FormulaC10H17N2P
Molecular Weight196.23 g/mol
Exact Mass196.11
IUPAC Name4-[2-(methylamino)-1-phosphanylpropyl]aniline
SMILESCNC(C)C(P)c1ccc(N)cc1
InChIInChI=1S/C10H17N2P/c1-7(12-2)10(13)8-3-5-9(11)6-4-8/h3-7,10,12H,11,13H2,1-2H3
InChIKeyMVMFPYZNMUKYNN-UHFFFAOYSA-N
XLogP1.79
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[3-methyl-1-(methylamino)butyl]aniline
CID 116951997
4-[(R)-methylamino-(4-methylphenyl)methyl]aniline
CID 90212370
4-(1-fluoro-2-methylpropyl)aniline
CID 83855607
4-[(3R,4R)-4-(4-aminophenyl)hexan-3-yl]aniline
CID 6990315
4-(1-amino-2-methylpropyl)aniline
CID 55283645
4-[methylamino-(4-methylsulfanylphenyl)methyl]aniline
CID 116952045
4-[1-(dimethylamino)propan-2-yl]aniline
CID 115015271
4-[1-(methylamino)pentan-3-yl]aniline
CID 142395580
4-[1-(methylsulfamoylamino)ethyl]aniline
CID 114804323
4-[4-(4-aminophenyl)hex-4-en-2-yl]aniline
CID 159376150
4-[1-(2-methylpropylsulfanyl)ethyl]aniline
CID 61262045
4-[[(4-propan-2-ylphenyl)methylamino]methyl]aniline
CID 115212458

Frequently Asked Questions

What is the IUPAC name of 4-[2-(methylamino)-1-phosphanylpropyl]aniline?
The IUPAC name of 4-[2-(methylamino)-1-phosphanylpropyl]aniline (CID 89327462) is 4-[2-(methylamino)-1-phosphanylpropyl]aniline.
What is the SMILES notation for 4-[2-(methylamino)-1-phosphanylpropyl]aniline?
The canonical SMILES for 4-[2-(methylamino)-1-phosphanylpropyl]aniline is CNC(C)C(P)c1ccc(N)cc1.
What is the InChIKey of 4-[2-(methylamino)-1-phosphanylpropyl]aniline?
The InChIKey is MVMFPYZNMUKYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N2P/c1-7(12-2)10(13)8-3-5-9(11)6-4-8/h3-7,10,12H,11,13H2,1-2H3.
What are the key properties of 4-[2-(methylamino)-1-phosphanylpropyl]aniline?
4-[2-(methylamino)-1-phosphanylpropyl]aniline has a molecular weight of 196.23 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(methylamino)-1-phosphanylpropyl]aniline is sourced from PubChem (CID 89327462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).