cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine

C11H20FN — CID 144516911

IUPACcis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine
SMILESCC/C=C(\F)CN[C@@H]1CC[C@H](C)C1
InChIInChI=1S/C11H20FN/c1-3-4-10(12)8-13-11-6-5-9(2)7-11/h4,9,11,13H,3,5-8H2,1-2H3/b10-4-/t9-,11+/m0/s1
InChIKeyWEVKMLAVYNRCQM-BGBMWRPTSA-N
MW185.29 g/mol
LogP3.03
Rot. Bonds4

About cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine

cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine (PubChem CID 144516911) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine.

Molecular Properties

Compound Namecis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine
PubChem CID144516911
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC Namecis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine
SMILESCC/C=C(\F)CN[C@@H]1CC[C@H](C)C1
InChIInChI=1S/C11H20FN/c1-3-4-10(12)8-13-11-6-5-9(2)7-11/h4,9,11,13H,3,5-8H2,1-2H3/b10-4-/t9-,11+/m0/s1
InChIKeyWEVKMLAVYNRCQM-BGBMWRPTSA-N
XLogP3.03
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine?
The IUPAC name of cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine (CID 144516911) is cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine.
What is the SMILES notation for cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine?
The canonical SMILES for cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine is CC/C=C(\F)CN[C@@H]1CC[C@H](C)C1.
What is the InChIKey of cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine?
The InChIKey is WEVKMLAVYNRCQM-BGBMWRPTSA-N. The full InChI is InChI=1S/C11H20FN/c1-3-4-10(12)8-13-11-6-5-9(2)7-11/h4,9,11,13H,3,5-8H2,1-2H3/b10-4-/t9-,11+/m0/s1.
What are the key properties of cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine?
cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine has a molecular weight of 185.29 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3S)-N-[(Z)-2-fluoropent-2-enyl]-3-methylcyclopentan-1-amine is sourced from PubChem (CID 144516911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).