N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine

C15H26FN — CID 143786509

IUPACN-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine
SMILESC=C(CC1CCCC1)NC(C(=C)C)C(C)(C)F
InChIInChI=1S/C15H26FN/c1-11(2)14(15(4,5)16)17-12(3)10-13-8-6-7-9-13/h13-14,17H,1,3,6-10H2,2,4-5H3
InChIKeyHDHOJLANTODDKS-UHFFFAOYSA-N
MW239.38 g/mol
LogP4.36
Rot. Bonds6

About N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine

N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine (PubChem CID 143786509) has the molecular formula C15H26FN and a molecular weight of 239.38 g/mol. Its IUPAC name is N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine.

Molecular Properties

Compound NameN-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine
PubChem CID143786509
Molecular FormulaC15H26FN
Molecular Weight239.38 g/mol
Exact Mass239.20
IUPAC NameN-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine
SMILESC=C(CC1CCCC1)NC(C(=C)C)C(C)(C)F
InChIInChI=1S/C15H26FN/c1-11(2)14(15(4,5)16)17-12(3)10-13-8-6-7-9-13/h13-14,17H,1,3,6-10H2,2,4-5H3
InChIKeyHDHOJLANTODDKS-UHFFFAOYSA-N
XLogP4.36
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.38
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2S,4S)-4-fluoro-2-(3-methylbut-1-en-2-yl)pyrrolidine
CID 89494790
4-Fluoro-4-methyl-2-(3-methylbut-1-en-2-yl)pyrrolidine
CID 91554489
4-Fluoro-2-(3-methylpent-1-en-2-yl)pyrrolidine
CID 123254453
5-fluoro-6-methyl-N-(3-methylbuta-1,3-dien-2-yl)heptan-1-amine
CID 135276332
2-ethyl-4-fluoro-3-propyl-2,3-dihydro-1H-pyrrole
CID 141793033
3,5-dimethyl-N-(2,2,2-trifluoroethyl)hept-1-en-2-amine
CID 143513257
(2R)-2-N-[(1E)-2-amino-3-methylbuta-1,3-dienyl]-5-ethyl-3-fluoroheptane-2,4-diamine
CID 163915815
2-fluoro-3-methyl-N-(3-methylbut-1-en-2-yl)-N'-propan-2-ylhexane-1,6-diamine
CID 170005542
2-fluoro-N',3-dimethyl-N-(3-methylbut-1-en-2-yl)hexane-1,6-diamine
CID 170040888
2-fluoro-3,11-dimethyl-N-(3-methylbut-1-en-2-yl)-10-methylidenedodecan-1-amine
CID 174252655
N-(1-cyclopropylpropan-2-yl)-3-fluoro-4-methylpent-1-en-2-amine
CID 174325971
N-[1-(4,4-difluorocyclohexyl)ethenyl]propan-2-amine
CID 174336602

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine?
The IUPAC name of N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine (CID 143786509) is N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine.
What is the SMILES notation for N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine?
The canonical SMILES for N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine is C=C(CC1CCCC1)NC(C(=C)C)C(C)(C)F.
What is the InChIKey of N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine?
The InChIKey is HDHOJLANTODDKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26FN/c1-11(2)14(15(4,5)16)17-12(3)10-13-8-6-7-9-13/h13-14,17H,1,3,6-10H2,2,4-5H3.
What are the key properties of N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine?
N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine has a molecular weight of 239.38 g/mol, XLogP of 4.36, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylprop-1-en-2-yl)-4-fluoro-2,4-dimethylpent-1-en-3-amine is sourced from PubChem (CID 143786509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).