(2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine

C7H12NP — CID 139493202

IUPAC(2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine
SMILESC=C/C=C\C(N)=C(/C)P
InChIInChI=1S/C7H12NP/c1-3-4-5-7(8)6(2)9/h3-5H,1,8-9H2,2H3/b5-4-,7-6-
InChIKeyIIRPMDLNGQRERD-RZSVFLSASA-N
MW141.15 g/mol
LogP1.79
Rot. Bonds2

About (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine

(2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine (PubChem CID 139493202) has the molecular formula C7H12NP and a molecular weight of 141.15 g/mol. Its IUPAC name is (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine.

Molecular Properties

Compound Name(2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine
PubChem CID139493202
Molecular FormulaC7H12NP
Molecular Weight141.15 g/mol
Exact Mass141.07
IUPAC Name(2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine
SMILESC=C/C=C\C(N)=C(/C)P
InChIInChI=1S/C7H12NP/c1-3-4-5-7(8)6(2)9/h3-5H,1,8-9H2,2H3/b5-4-,7-6-
InChIKeyIIRPMDLNGQRERD-RZSVFLSASA-N
XLogP1.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.15
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;(2Z)-penta-2,4-dienamide
CID 143902044
(2E,4E)-3-amino-2-[(E)-pent-2-en-4-yn-2-yl]hepta-2,4,6-trienenitrile
CID 143427931
6-bromo-5-methylidenehepta-1,3-diene
CID 123730228
(2Z,4Z)-hepta-2,4,6-triene-2,3-diol
CID 130419647
6-methyl-5-methylidenehepta-1,3,6-triene
CID 54100301
(3Z,5E,6Z)-4-ethenyl-5-ethylidenenona-1,3,6,8-tetraen-3-amine
CID 134224473
2-methylsulfanylhexa-1,3,5-triene
CID 123672655
(2E,4E,5Z)-4-ethylideneocta-2,5,7-trienamide
CID 118357992
[(2Z,4Z)-3-[(Z)-1-ethynyl-2-methylbut-2-enyl]hepta-2,4,6-trien-2-yl]phosphane
CID 167280878
(3Z,7Z,11Z)-2-methyl-5,6,9,10-tetramethylidenetetradeca-1,3,7,11,13-pentaene
CID 143476273
penta-2,4-dienimidamide
CID 141285400
(3Z,5E,6E)-5-ethylidene-6-methylocta-1,3,6-triene
CID 155717462

Frequently Asked Questions

What is the IUPAC name of (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine?
The IUPAC name of (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine (CID 139493202) is (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine.
What is the SMILES notation for (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine?
The canonical SMILES for (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine is C=C/C=C\C(N)=C(/C)P.
What is the InChIKey of (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine?
The InChIKey is IIRPMDLNGQRERD-RZSVFLSASA-N. The full InChI is InChI=1S/C7H12NP/c1-3-4-5-7(8)6(2)9/h3-5H,1,8-9H2,2H3/b5-4-,7-6-.
What are the key properties of (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine?
(2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine has a molecular weight of 141.15 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine is sourced from PubChem (CID 139493202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).