ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine

C9H20N2 — CID 142059909

IUPACethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine
SMILESC=C.C=C/C(N)=C(\C)N.CC
InChIInChI=1S/C5H10N2.C2H6.C2H4/c1-3-5(7)4(2)6;2*1-2/h3H,1,6-7H2,2H3;1-2H3;1-2H2/b5-4-;;
InChIKeyPPFDMSAGJKEKMP-WNCVTPEDSA-N
MW156.27 g/mol
LogP2.15
Rot. Bonds1

About ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine

ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine (PubChem CID 142059909) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine.

Molecular Properties

Compound Nameethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine
PubChem CID142059909
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Nameethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine
SMILESC=C.C=C/C(N)=C(\C)N.CC
InChIInChI=1S/C5H10N2.C2H6.C2H4/c1-3-5(7)4(2)6;2*1-2/h3H,1,6-7H2,2H3;1-2H3;1-2H2/b5-4-;;
InChIKeyPPFDMSAGJKEKMP-WNCVTPEDSA-N
XLogP2.15
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-methylpenta-2,4-dien-2-amine
CID 141358440
(3Z)-4-bromohexa-1,3,5-trien-3-amine;ethane
CID 143722331
ethane;(3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine;molecular hydrogen
CID 142384162
(3E)-4-(propan-2-ylideneamino)penta-1,3-dien-3-amine
CID 146327197
acetic acid;(3Z)-4-aminohexa-1,3,5-trien-3-ol
CID 142913066
2-(1-aminoprop-2-enylidene)propanedinitrile
CID 18620400
(Z)-but-2-en-2-amine;ethane;ethenamine
CID 143379680
acetamide;prop-2-enamide
CID 158566181
(3Z)-4-methoxy-5-methylhexa-1,3,5-trien-3-amine
CID 144610850
(3Z,5Z)-4-prop-1-en-2-ylhepta-1,3,5-trien-3-amine
CID 155176361
ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine
CID 142131627
(1Z)-1-[dihydroxy(methylidene)-λ5-phosphanyl]-1-(methylideneamino)buta-1,3-dien-2-amine;ethane
CID 156802390

Frequently Asked Questions

What is the IUPAC name of ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine?
The IUPAC name of ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine (CID 142059909) is ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine.
What is the SMILES notation for ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine?
The canonical SMILES for ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine is C=C.C=C/C(N)=C(\C)N.CC.
What is the InChIKey of ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine?
The InChIKey is PPFDMSAGJKEKMP-WNCVTPEDSA-N. The full InChI is InChI=1S/C5H10N2.C2H6.C2H4/c1-3-5(7)4(2)6;2*1-2/h3H,1,6-7H2,2H3;1-2H3;1-2H2/b5-4-;;.
What are the key properties of ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine?
ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine has a molecular weight of 156.27 g/mol, XLogP of 2.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine is sourced from PubChem (CID 142059909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).