N,N-dibutyl-4-phosphanylaniline

C14H24NP — CID 175417850

IUPACN,N-dibutyl-4-phosphanylaniline
SMILESCCCCN(CCCC)c1ccc(P)cc1
InChIInChI=1S/C14H24NP/c1-3-5-11-15(12-6-4-2)13-7-9-14(16)10-8-13/h7-10H,3-6,11-12,16H2,1-2H3
InChIKeyAHXBEOLTSYCMRL-UHFFFAOYSA-N
MW237.33 g/mol
LogP3.59
Rot. Bonds7

About N,N-dibutyl-4-phosphanylaniline

N,N-dibutyl-4-phosphanylaniline (PubChem CID 175417850) has the molecular formula C14H24NP and a molecular weight of 237.33 g/mol. Its IUPAC name is N,N-dibutyl-4-phosphanylaniline.

Molecular Properties

Compound NameN,N-dibutyl-4-phosphanylaniline
PubChem CID175417850
Molecular FormulaC14H24NP
Molecular Weight237.33 g/mol
Exact Mass237.16
IUPAC NameN,N-dibutyl-4-phosphanylaniline
SMILESCCCCN(CCCC)c1ccc(P)cc1
InChIInChI=1S/C14H24NP/c1-3-5-11-15(12-6-4-2)13-7-9-14(16)10-8-13/h7-10H,3-6,11-12,16H2,1-2H3
InChIKeyAHXBEOLTSYCMRL-UHFFFAOYSA-N
XLogP3.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N,N-dibutyl-4-phosphanylaniline 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

1-N,1-N,4-N,4-N-tetraoctylbenzene-1,4-diamine
CID 71367267
N,N-dibutyl-4-[[4-(dibutylamino)phenyl]methyl]aniline
CID 67427433
N,N-dibutyl-4-fluoroaniline
CID 15399711
4-(dibutylamino)benzaldehyde
CID 605391
[4-(dibutylamino)phenyl]boronic acid
CID 130141719
4-[4-(dibutylamino)phenyl]aniline
CID 174369648
1-N,1-N,4-N,4-N-tetrapropylbenzene-1,4-diamine
CID 70004923
N,N-diheptyl-4-methylaniline
CID 20558578
ethane;4-methyl-N,N-dipentylaniline
CID 144729542
N,4-dibutyl-N-octylaniline
CID 175203597
1-N,4-N-dibutyl-1-N,4-N-dimethylbenzene-1,4-diamine
CID 18699513
tris[4-(dibutylamino)phenyl]azanium hexafluorophosphate
CID 172867632

Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-4-phosphanylaniline?
The IUPAC name of N,N-dibutyl-4-phosphanylaniline (CID 175417850) is N,N-dibutyl-4-phosphanylaniline.
What is the SMILES notation for N,N-dibutyl-4-phosphanylaniline?
The canonical SMILES for N,N-dibutyl-4-phosphanylaniline is CCCCN(CCCC)c1ccc(P)cc1.
What is the InChIKey of N,N-dibutyl-4-phosphanylaniline?
The InChIKey is AHXBEOLTSYCMRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24NP/c1-3-5-11-15(12-6-4-2)13-7-9-14(16)10-8-13/h7-10H,3-6,11-12,16H2,1-2H3.
What are the key properties of N,N-dibutyl-4-phosphanylaniline?
N,N-dibutyl-4-phosphanylaniline has a molecular weight of 237.33 g/mol, XLogP of 3.59, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-4-phosphanylaniline is sourced from PubChem (CID 175417850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).