(Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine

C10H17FN2 — CID 153352847

IUPAC(Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine
SMILESC=C/C=C(\C=C/NC)CCN(C)F
InChIInChI=1S/C10H17FN2/c1-4-5-10(6-8-12-2)7-9-13(3)11/h4-6,8,12H,1,7,9H2,2-3H3/b8-6-,10-5+
InChIKeySAPKCAWIEYPJIJ-LTFLHPNNSA-N
MW184.26 g/mol
LogP2.04
Rot. Bonds6

About (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine

(Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine (PubChem CID 153352847) has the molecular formula C10H17FN2 and a molecular weight of 184.26 g/mol. Its IUPAC name is (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine.

Molecular Properties

Compound Name(Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine
PubChem CID153352847
Molecular FormulaC10H17FN2
Molecular Weight184.26 g/mol
Exact Mass184.14
IUPAC Name(Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine
SMILESC=C/C=C(\C=C/NC)CCN(C)F
InChIInChI=1S/C10H17FN2/c1-4-5-10(6-8-12-2)7-9-13(3)11/h4-6,8,12H,1,7,9H2,2-3H3/b8-6-,10-5+
InChIKeySAPKCAWIEYPJIJ-LTFLHPNNSA-N
XLogP2.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine?
The IUPAC name of (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine (CID 153352847) is (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine.
What is the SMILES notation for (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine?
The canonical SMILES for (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine is C=C/C=C(\C=C/NC)CCN(C)F.
What is the InChIKey of (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine?
The InChIKey is SAPKCAWIEYPJIJ-LTFLHPNNSA-N. The full InChI is InChI=1S/C10H17FN2/c1-4-5-10(6-8-12-2)7-9-13(3)11/h4-6,8,12H,1,7,9H2,2-3H3/b8-6-,10-5+.
What are the key properties of (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine?
(Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine has a molecular weight of 184.26 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,3Z)-N'-fluoro-N,N'-dimethyl-3-prop-2-enylidenepent-1-ene-1,5-diamine is sourced from PubChem (CID 153352847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).