ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide

C8H16N2 — CID 143028348

IUPACethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide
SMILESCC.[H]/N=C/N=C(C)/C=C\C
InChIInChI=1S/C6H10N2.C2H6/c1-3-4-6(2)8-5-7;1-2/h3-5,7H,1-2H3;1-2H3/b4-3-,7-5+,8-6+;
InChIKeySFNFVLFBWILJSW-CMAXMUNGSA-N
MW140.23 g/mol
LogP2.66
Rot. Bonds2

About ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide

ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide (PubChem CID 143028348) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide.

Molecular Properties

Compound Nameethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide
PubChem CID143028348
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Nameethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide
SMILESCC.[H]/N=C/N=C(C)/C=C\C
InChIInChI=1S/C6H10N2.C2H6/c1-3-4-6(2)8-5-7;1-2/h3-5,7H,1-2H3;1-2H3/b4-3-,7-5+,8-6+;
InChIKeySFNFVLFBWILJSW-CMAXMUNGSA-N
XLogP2.66
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.66
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'}

Analyze ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(Z)-pent-3-en-2-ylidene]methanimidamide
CID 87693670
N-[(Z)-2-methylhex-4-en-3-ylidene]methanimidamide
CID 88580454
N-[(Z)-3-methylpent-3-en-2-ylidene]methanimidamide
CID 117804999
N-[(Z)-hept-2-en-4-ylidene]methanimidamide
CID 118327143
N-[(Z)-oct-2-en-4-ylidene]methanimidamide
CID 118327149
N-[(Z)-hex-4-en-3-ylidene]methanimidamide
CID 118327150
N-[(Z)-4-iodopent-3-en-2-ylidene]methanimidamide
CID 118516106
N-[(1E,4Z)-1-(methylideneamino)hexa-1,4-dien-3-ylidene]methanimidamide
CID 118973480
N-[(E)-hex-3-en-2-ylidene]ethanimidamide
CID 122691937
[[(Z)-pent-3-en-2-ylidene]amino]methanamine
CID 124023882
N-[(3E,5E)-7-methylocta-3,5-dien-2-ylidene]methanimidamide
CID 126593765
N-[(Z)-3-iminohex-4-enylidene]methanimidamide
CID 129106355

Frequently Asked Questions

What is the IUPAC name of ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide?
The IUPAC name of ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide (CID 143028348) is ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide.
What is the SMILES notation for ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide?
The canonical SMILES for ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide is CC.[H]/N=C/N=C(C)/C=C\C.
What is the InChIKey of ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide?
The InChIKey is SFNFVLFBWILJSW-CMAXMUNGSA-N. The full InChI is InChI=1S/C6H10N2.C2H6/c1-3-4-6(2)8-5-7;1-2/h3-5,7H,1-2H3;1-2H3/b4-3-,7-5+,8-6+;.
What are the key properties of ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide?
ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide has a molecular weight of 140.23 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[(Z)-pent-3-en-2-ylidene]methanimidamide is sourced from PubChem (CID 143028348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).