1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine

C14H20FN — CID 81032819

IUPAC1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine
SMILESCNCC1CCCC1Cc1ccc(F)cc1
InChIInChI=1S/C14H20FN/c1-16-10-13-4-2-3-12(13)9-11-5-7-14(15)8-6-11/h5-8,12-13,16H,2-4,9-10H2,1H3
InChIKeyOVMQVPKDWXCXBZ-UHFFFAOYSA-N
MW221.32 g/mol
LogP3.00
Rot. Bonds4

About 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine

1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine (PubChem CID 81032819) has the molecular formula C14H20FN and a molecular weight of 221.32 g/mol. Its IUPAC name is 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine
PubChem CID81032819
Molecular FormulaC14H20FN
Molecular Weight221.32 g/mol
Exact Mass221.16
IUPAC Name1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine
SMILESCNCC1CCCC1Cc1ccc(F)cc1
InChIInChI=1S/C14H20FN/c1-16-10-13-4-2-3-12(13)9-11-5-7-14(15)8-6-11/h5-8,12-13,16H,2-4,9-10H2,1H3
InChIKeyOVMQVPKDWXCXBZ-UHFFFAOYSA-N
XLogP3.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine?
The IUPAC name of 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine (CID 81032819) is 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine is CNCC1CCCC1Cc1ccc(F)cc1.
What is the InChIKey of 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine?
The InChIKey is OVMQVPKDWXCXBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN/c1-16-10-13-4-2-3-12(13)9-11-5-7-14(15)8-6-11/h5-8,12-13,16H,2-4,9-10H2,1H3.
What are the key properties of 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine?
1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine has a molecular weight of 221.32 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(4-fluorophenyl)methyl]cyclopentyl]-N-methylmethanamine is sourced from PubChem (CID 81032819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).