(Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine

C10H17F2N3 — CID 143410207

IUPAC(Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine
SMILESC/C=C(\C=C/CC)N(N)/C=C(\N)C(F)F
InChIInChI=1S/C10H17F2N3/c1-3-5-6-8(4-2)15(14)7-9(13)10(11)12/h4-7,10H,3,13-14H2,1-2H3/b6-5-,8-4+,9-7-
InChIKeyOIPZJNKNEWWIID-IRDJHOSWSA-N
MW217.26 g/mol
LogP2.10
Rot. Bonds5

About (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine

(Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine (PubChem CID 143410207) has the molecular formula C10H17F2N3 and a molecular weight of 217.26 g/mol. Its IUPAC name is (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine
PubChem CID143410207
Molecular FormulaC10H17F2N3
Molecular Weight217.26 g/mol
Exact Mass217.14
IUPAC Name(Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine
SMILESC/C=C(\C=C/CC)N(N)/C=C(\N)C(F)F
InChIInChI=1S/C10H17F2N3/c1-3-5-6-8(4-2)15(14)7-9(13)10(11)12/h4-7,10H,3,13-14H2,1-2H3/b6-5-,8-4+,9-7-
InChIKeyOIPZJNKNEWWIID-IRDJHOSWSA-N
XLogP2.10
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine 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

(2S,3Z)-5-methyl-3-[2-methyl-2-[(Z)-1,1,1-trifluorobut-2-en-2-yl]hydrazinyl]hexa-3,5-dien-2-amine
CID 137447313
2-(trifluoromethyl)-2H-pyridine-1,4-diamine
CID 141002270
3-ethyl-4-methyl-5-[(1E,3Z)-2-(trifluoromethyl)hexa-1,3-dienyl]-1,2-dihydrotriazole
CID 178136812
3,4-dimethyl-5-[(1E,3Z)-2-(trifluoromethyl)hexa-1,3-dienyl]-1,2-dihydrotriazole;ethane
CID 178136820
ethane;3-ethyl-4-methyl-5-[(1E,3Z)-2-(trifluoromethyl)hexa-1,3-dienyl]-1,2-dihydrotriazole
CID 178136839
3,4-dimethyl-5-[(1E,3Z)-2-(trifluoromethyl)hexa-1,3-dienyl]-1,2-dihydrotriazole
CID 178136821
(2Z)-2-(1-aminopropylidene)pyridin-1-amine
CID 142619215
(Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine;ethane
CID 143410206
1-[(Z)-but-1-enyl]-1-[(3Z)-hexa-1,3-dien-3-yl]-2-methylhydrazine;ethane
CID 144672530
ethane;1-ethenyl-1-[(3Z)-hexa-1,3-dien-3-yl]-2-methylhydrazine
CID 145001559
ethane;1-[(3Z)-hexa-1,3-dien-3-yl]-2-methyl-1-[(Z)-prop-1-enyl]hydrazine
CID 145001618
(3Z,5Z)-4-[amino(ethenyl)amino]-2-methylhepta-3,5-dien-3-amine
CID 166773733

Frequently Asked Questions

What is the IUPAC name of (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine?
The IUPAC name of (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine (CID 143410207) is (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine.
What is the SMILES notation for (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine?
The canonical SMILES for (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine is C/C=C(\C=C/CC)N(N)/C=C(\N)C(F)F.
What is the InChIKey of (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine?
The InChIKey is OIPZJNKNEWWIID-IRDJHOSWSA-N. The full InChI is InChI=1S/C10H17F2N3/c1-3-5-6-8(4-2)15(14)7-9(13)10(11)12/h4-7,10H,3,13-14H2,1-2H3/b6-5-,8-4+,9-7-.
What are the key properties of (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine?
(Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine has a molecular weight of 217.26 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[amino-[(2E,4Z)-hepta-2,4-dien-3-yl]amino]-3,3-difluoroprop-1-en-2-amine is sourced from PubChem (CID 143410207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).