N-(2-methylphosphanylethenyl)propan-1-amine

C6H14NP — CID 129054103

IUPACN-(2-methylphosphanylethenyl)propan-1-amine
SMILESCCCNC=CPC
InChIInChI=1S/C6H14NP/c1-3-4-7-5-6-8-2/h5-8H,3-4H2,1-2H3
InChIKeyAKDOOZGAZZUXMG-UHFFFAOYSA-N
MW131.16 g/mol
LogP1.77
Rot. Bonds4

About N-(2-methylphosphanylethenyl)propan-1-amine

N-(2-methylphosphanylethenyl)propan-1-amine (PubChem CID 129054103) has the molecular formula C6H14NP and a molecular weight of 131.16 g/mol. Its IUPAC name is N-(2-methylphosphanylethenyl)propan-1-amine.

Molecular Properties

Compound NameN-(2-methylphosphanylethenyl)propan-1-amine
PubChem CID129054103
Molecular FormulaC6H14NP
Molecular Weight131.16 g/mol
Exact Mass131.09
IUPAC NameN-(2-methylphosphanylethenyl)propan-1-amine
SMILESCCCNC=CPC
InChIInChI=1S/C6H14NP/c1-3-4-7-5-6-8-2/h5-8H,3-4H2,1-2H3
InChIKeyAKDOOZGAZZUXMG-UHFFFAOYSA-N
XLogP1.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.16
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;(1E,5E)-N-propylhepta-1,5-dien-1-amine
CID 144808734
N-ethenylpropan-1-amine;methane
CID 158278470
[(E)-but-1-enyl]-methylphosphane
CID 173168130
N-[(Z)-prop-1-enyl]butan-1-amine;hydrochloride
CID 155386261
(Z)-N-butylhex-1-en-1-amine
CID 146262840
N-[(E)-prop-1-enyl]dodecan-1-amine
CID 88674859
propylhydrazine;hydroiodide
CID 172758211
(E)-2-N-methyl-1-N-propylbut-1-ene-1,2-diamine
CID 170238799
N-(cyclobutylidenemethyl)propan-1-amine
CID 142065368
3-methyl-2-prop-1-en-2-yl-N-propylbuta-1,3-dien-1-amine
CID 170028248
(Z)-2-amino-3-(propylamino)prop-2-en-1-ol
CID 155484558
2-methyl-3-(propylamino)prop-2-enal;hydrochloride
CID 175310353

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphosphanylethenyl)propan-1-amine?
The IUPAC name of N-(2-methylphosphanylethenyl)propan-1-amine (CID 129054103) is N-(2-methylphosphanylethenyl)propan-1-amine.
What is the SMILES notation for N-(2-methylphosphanylethenyl)propan-1-amine?
The canonical SMILES for N-(2-methylphosphanylethenyl)propan-1-amine is CCCNC=CPC.
What is the InChIKey of N-(2-methylphosphanylethenyl)propan-1-amine?
The InChIKey is AKDOOZGAZZUXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14NP/c1-3-4-7-5-6-8-2/h5-8H,3-4H2,1-2H3.
What are the key properties of N-(2-methylphosphanylethenyl)propan-1-amine?
N-(2-methylphosphanylethenyl)propan-1-amine has a molecular weight of 131.16 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphosphanylethenyl)propan-1-amine is sourced from PubChem (CID 129054103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).