(2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine

C11H23N2P — CID 155021868

IUPAC(2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine
SMILESC=C(/C=C(\CNC(C)C)C(C)C)NP
InChIInChI=1S/C11H23N2P/c1-8(2)11(6-10(5)13-14)7-12-9(3)4/h6,8-9,12-13H,5,7,14H2,1-4H3/b11-6+
InChIKeyGDEOKQDIUASFAS-IZZDOVSWSA-N
MW214.29 g/mol
LogP2.46
Rot. Bonds6

About (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine

(2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine (PubChem CID 155021868) has the molecular formula C11H23N2P and a molecular weight of 214.29 g/mol. Its IUPAC name is (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine.

Molecular Properties

Compound Name(2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine
PubChem CID155021868
Molecular FormulaC11H23N2P
Molecular Weight214.29 g/mol
Exact Mass214.16
IUPAC Name(2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine
SMILESC=C(/C=C(\CNC(C)C)C(C)C)NP
InChIInChI=1S/C11H23N2P/c1-8(2)11(6-10(5)13-14)7-12-9(3)4/h6,8-9,12-13H,5,7,14H2,1-4H3/b11-6+
InChIKeyGDEOKQDIUASFAS-IZZDOVSWSA-N
XLogP2.46
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-methyl-N,2-di(propan-2-yl)pent-2-en-1-amine
CID 79339268
2-[(4-chlorophenyl)methylidene]-3-methyl-N-propan-2-ylbutan-1-amine
CID 79338727
(Z)-N,2-di(propan-2-yl)hept-2-en-1-amine
CID 139548782
3-methyl-2-(naphthalen-2-ylmethylidene)-N-propan-2-ylbutan-1-amine
CID 79339001
2-[[4-(methoxymethyl)phenyl]methylidene]-3-methyl-N-propan-2-ylbutan-1-amine
CID 79338904
(3Z)-5-methyl-2-methylidene-N-propan-2-ylhexa-3,5-dien-1-amine
CID 144585216
(E)-2-ethenyl-N-propan-2-ylbut-2-en-1-amine
CID 156896524
3-methyl-2-[(4-methylcyclohexyl)methylidene]-N-propan-2-ylbutan-1-amine
CID 115278136
(2E)-3-methyl-2-[(5-methyl-2-pyridinyl)methylidene]-N-propan-2-ylbutan-1-amine
CID 81313344
2-[[2-(methoxymethyl)phenyl]methylidene]-3-methyl-N-propan-2-ylbutan-1-amine
CID 79338998
2-[(4-imidazol-1-ylphenyl)methylidene]-3-methyl-N-propan-2-ylbutan-1-amine
CID 79342203
3-methyl-4-(propan-2-ylamino)but-2-enoic acid
CID 103230324

Frequently Asked Questions

What is the IUPAC name of (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine?
The IUPAC name of (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine (CID 155021868) is (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine.
What is the SMILES notation for (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine?
The canonical SMILES for (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine is C=C(/C=C(\CNC(C)C)C(C)C)NP.
What is the InChIKey of (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine?
The InChIKey is GDEOKQDIUASFAS-IZZDOVSWSA-N. The full InChI is InChI=1S/C11H23N2P/c1-8(2)11(6-10(5)13-14)7-12-9(3)4/h6,8-9,12-13H,5,7,14H2,1-4H3/b11-6+.
What are the key properties of (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine?
(2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine has a molecular weight of 214.29 g/mol, XLogP of 2.46, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-4-N-phosphanyl-1-N,2-di(propan-2-yl)penta-2,4-diene-1,4-diamine is sourced from PubChem (CID 155021868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).