N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline

C15H19NP2 — CID 169286170

IUPACN,N-bis(phosphanyl)-4-(4-propylphenyl)aniline
SMILESCCCc1ccc(-c2ccc(N(P)P)cc2)cc1
InChIInChI=1S/C15H19NP2/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(17)18/h4-11H,2-3,17-18H2,1H3
InChIKeyOPTVJNAHRCVOAS-UHFFFAOYSA-N
MW275.27 g/mol
LogP4.69
Rot. Bonds4

About N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline

N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline (PubChem CID 169286170) has the molecular formula C15H19NP2 and a molecular weight of 275.27 g/mol. Its IUPAC name is N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline.

Molecular Properties

Compound NameN,N-bis(phosphanyl)-4-(4-propylphenyl)aniline
PubChem CID169286170
Molecular FormulaC15H19NP2
Molecular Weight275.27 g/mol
Exact Mass275.10
IUPAC NameN,N-bis(phosphanyl)-4-(4-propylphenyl)aniline
SMILESCCCc1ccc(-c2ccc(N(P)P)cc2)cc1
InChIInChI=1S/C15H19NP2/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(17)18/h4-11H,2-3,17-18H2,1H3
InChIKeyOPTVJNAHRCVOAS-UHFFFAOYSA-N
XLogP4.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.27
LogP ≤ 54.69
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

4-heptyl-N,N-bis(phosphanyl)aniline
CID 169286189
4-nonyl-N,N-bis(phosphanyl)aniline
CID 169286153
N-[4-(4-aminophenyl)phenyl]-4-propyl-N-(4-propylphenyl)aniline
CID 67658783
1-methyl-4-(4-propylphenyl)benzene
CID 157416879
1-ethyl-4-[4-(4-propylphenyl)phenyl]benzene
CID 58975771
1-methyl-4-[4-[2-(4-propylphenyl)ethyl]phenyl]benzene
CID 140875006
ethane;1-ethyl-4-(4-propylphenyl)benzene
CID 142388235
1-(4-pentylphenyl)-4-[2-(4-propylphenyl)ethyl]benzene
CID 19906985
1-N,4-N-diphenyl-1-N,4-N-bis(4-propylphenyl)benzene-1,4-diamine
CID 157362668
magnesium;1-phenyl-4-propylbenzene;bromide
CID 172966719
N,N-dimethyl-4-[5-[4-(4-propylphenyl)phenyl]-1,3,4-oxadiazol-2-yl]aniline
CID 101081658
1-methyl-4-phenylbenzene;1-phenyl-4-propylbenzene
CID 143481088

Frequently Asked Questions

What is the IUPAC name of N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline?
The IUPAC name of N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline (CID 169286170) is N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline.
What is the SMILES notation for N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline?
The canonical SMILES for N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline is CCCc1ccc(-c2ccc(N(P)P)cc2)cc1.
What is the InChIKey of N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline?
The InChIKey is OPTVJNAHRCVOAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NP2/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(17)18/h4-11H,2-3,17-18H2,1H3.
What are the key properties of N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline?
N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline has a molecular weight of 275.27 g/mol, XLogP of 4.69, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(phosphanyl)-4-(4-propylphenyl)aniline is sourced from PubChem (CID 169286170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).