N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide

C15H25N2P — CID 67297899

IUPACN-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide
SMILESC/N=C(/NP(C(C)C)C(C)C)c1ccc(C)cc1
InChIInChI=1S/C15H25N2P/c1-11(2)18(12(3)4)17-15(16-6)14-9-7-13(5)8-10-14/h7-12H,1-6H3,(H,16,17)
InChIKeyPJVRCCZFZJFVLX-UHFFFAOYSA-N
MW264.35 g/mol
LogP4.17
Rot. Bonds4

About N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide

N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide (PubChem CID 67297899) has the molecular formula C15H25N2P and a molecular weight of 264.35 g/mol. Its IUPAC name is N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide.

Molecular Properties

Compound NameN-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide
PubChem CID67297899
Molecular FormulaC15H25N2P
Molecular Weight264.35 g/mol
Exact Mass264.18
IUPAC NameN-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide
SMILESC/N=C(/NP(C(C)C)C(C)C)c1ccc(C)cc1
InChIInChI=1S/C15H25N2P/c1-11(2)18(12(3)4)17-15(16-6)14-9-7-13(5)8-10-14/h7-12H,1-6H3,(H,16,17)
InChIKeyPJVRCCZFZJFVLX-UHFFFAOYSA-N
XLogP4.17
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide?
The IUPAC name of N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide (CID 67297899) is N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide.
What is the SMILES notation for N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide?
The canonical SMILES for N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide is C/N=C(/NP(C(C)C)C(C)C)c1ccc(C)cc1.
What is the InChIKey of N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide?
The InChIKey is PJVRCCZFZJFVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N2P/c1-11(2)18(12(3)4)17-15(16-6)14-9-7-13(5)8-10-14/h7-12H,1-6H3,(H,16,17).
What are the key properties of N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide?
N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide has a molecular weight of 264.35 g/mol, XLogP of 4.17, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-di(propan-2-yl)phosphanyl-N',4-dimethylbenzenecarboximidamide is sourced from PubChem (CID 67297899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).