(Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine

C11H23FN2 — CID 89176341

IUPAC(Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine
SMILESCC(F)CC(/C=C\CN(C)C)C(C)N
InChIInChI=1S/C11H23FN2/c1-9(12)8-11(10(2)13)6-5-7-14(3)4/h5-6,9-11H,7-8,13H2,1-4H3/b6-5-
InChIKeyBEYNHTHTQXRAQH-WAYWQWQTSA-N
MW202.32 g/mol
LogP1.82
Rot. Bonds6

About (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine

(Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine (PubChem CID 89176341) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine.

Molecular Properties

Compound Name(Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine
PubChem CID89176341
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC Name(Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine
SMILESCC(F)CC(/C=C\CN(C)C)C(C)N
InChIInChI=1S/C11H23FN2/c1-9(12)8-11(10(2)13)6-5-7-14(3)4/h5-6,9-11H,7-8,13H2,1-4H3/b6-5-
InChIKeyBEYNHTHTQXRAQH-WAYWQWQTSA-N
XLogP1.82
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[3-(Dimethylamino)propyl]-3-fluorocyclohexa-1,5-diene-1,4-diamine
CID 67104903
5-(aminomethyl)-3-fluoro-N,N-dimethylcyclohex-2-en-1-amine
CID 117694656
1-cyclohex-3-en-1-yl-N-(2-fluoroethyl)propan-2-amine
CID 129045764
3-fluoro-4-propan-2-yl-2-[(Z)-prop-1-enyl]-1,2,3,6-tetrahydropyridine
CID 138655203
(E)-3-fluoro-N-methyl-2-propylhex-4-en-1-amine
CID 139376285
(Z,3R,5S,9R)-3-ethyl-5-fluoro-1-N,3,5-trimethyldec-7-ene-1,9-diamine
CID 139423571
1-[3-(Dimethylamino)propyl]-4-fluorocyclohexa-3,5-diene-1,2-diamine
CID 142804247
1-[3-(Dimethylamino)propyl]-5-fluorocyclohexa-3,5-diene-1,2-diamine
CID 142804249
1-(6-Fluoro-5-methylcyclohex-2-en-1-yl)ethanamine
CID 166735001
(6E)-1-fluoro-8,9-dimethyldeca-6,9-dien-5-amine
CID 166855528
(E)-3-(fluoromethyl)-N-hex-1-en-3-yl-2,4-dimethylhex-4-en-1-amine
CID 166894171
(5Z,6Z,8Z)-5-ethylidene-1-fluoro-N,3-dimethyldeca-6,8-dien-2-amine
CID 169596197

Frequently Asked Questions

What is the IUPAC name of (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine?
The IUPAC name of (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine (CID 89176341) is (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine.
What is the SMILES notation for (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine?
The canonical SMILES for (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine is CC(F)CC(/C=C\CN(C)C)C(C)N.
What is the InChIKey of (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine?
The InChIKey is BEYNHTHTQXRAQH-WAYWQWQTSA-N. The full InChI is InChI=1S/C11H23FN2/c1-9(12)8-11(10(2)13)6-5-7-14(3)4/h5-6,9-11H,7-8,13H2,1-4H3/b6-5-.
What are the key properties of (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine?
(Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine has a molecular weight of 202.32 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-(2-fluoropropyl)-1-N,1-N-dimethylhex-2-ene-1,5-diamine is sourced from PubChem (CID 89176341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).