(4R)-4-fluoro-N-methylpent-2-en-3-amine

C6H12FN — CID 166850497

IUPAC(4R)-4-fluoro-N-methylpent-2-en-3-amine
SMILESCC=C(NC)[C@@H](C)F
InChIInChI=1S/C6H12FN/c1-4-6(8-3)5(2)7/h4-5,8H,1-3H3/t5-/m1/s1
InChIKeyKJRRAKJUZHYCOY-RXMQYKEDSA-N
MW117.17 g/mol
LogP1.47
Rot. Bonds2

About (4R)-4-fluoro-N-methylpent-2-en-3-amine

(4R)-4-fluoro-N-methylpent-2-en-3-amine (PubChem CID 166850497) has the molecular formula C6H12FN and a molecular weight of 117.17 g/mol. Its IUPAC name is (4R)-4-fluoro-N-methylpent-2-en-3-amine.

Molecular Properties

Compound Name(4R)-4-fluoro-N-methylpent-2-en-3-amine
PubChem CID166850497
Molecular FormulaC6H12FN
Molecular Weight117.17 g/mol
Exact Mass117.10
IUPAC Name(4R)-4-fluoro-N-methylpent-2-en-3-amine
SMILESCC=C(NC)[C@@H](C)F
InChIInChI=1S/C6H12FN/c1-4-6(8-3)5(2)7/h4-5,8H,1-3H3/t5-/m1/s1
InChIKeyKJRRAKJUZHYCOY-RXMQYKEDSA-N
XLogP1.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.17
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Pyrroline, 2-ethyl-
CID 23422339
N-methylcyclopenta-1,3-dien-1-amine
CID 14325423
2-Ethyl-1,4-dihydropyridine
CID 17998254
5-methyl-2,3-dihydro-1H-pyrrole
CID 19816704
2-(1-Fluoroprop-2-enyl)-1,4-dihydropyridine
CID 70438730
(E)-5-fluoro-N-methyloct-2-en-2-amine
CID 89209365
(Z)-3-fluoro-N-methylpent-2-en-2-amine
CID 89419652
3,5-difluoro-N-methylcyclopenta-1,3-dien-1-amine
CID 117753793
3-fluoro-N-methylcyclopenta-1,3-dien-1-amine
CID 117753829
4-fluoro-N-methylcyclopenta-1,4-dien-1-amine
CID 117753845
(E)-4-fluoro-N-methylbut-2-en-2-amine
CID 129208250
(Z)-1,1,1-trifluoro-N-methylpent-2-en-2-amine
CID 129271894

Frequently Asked Questions

What is the IUPAC name of (4R)-4-fluoro-N-methylpent-2-en-3-amine?
The IUPAC name of (4R)-4-fluoro-N-methylpent-2-en-3-amine (CID 166850497) is (4R)-4-fluoro-N-methylpent-2-en-3-amine.
What is the SMILES notation for (4R)-4-fluoro-N-methylpent-2-en-3-amine?
The canonical SMILES for (4R)-4-fluoro-N-methylpent-2-en-3-amine is CC=C(NC)[C@@H](C)F.
What is the InChIKey of (4R)-4-fluoro-N-methylpent-2-en-3-amine?
The InChIKey is KJRRAKJUZHYCOY-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H12FN/c1-4-6(8-3)5(2)7/h4-5,8H,1-3H3/t5-/m1/s1.
What are the key properties of (4R)-4-fluoro-N-methylpent-2-en-3-amine?
(4R)-4-fluoro-N-methylpent-2-en-3-amine has a molecular weight of 117.17 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-fluoro-N-methylpent-2-en-3-amine is sourced from PubChem (CID 166850497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).