2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine

C15H23FN2 — CID 82768565

IUPAC2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine
SMILESCN(Cc1cccc(F)c1)CC1(C)CCCC1N
InChIInChI=1S/C15H23FN2/c1-15(8-4-7-14(15)17)11-18(2)10-12-5-3-6-13(16)9-12/h3,5-6,9,14H,4,7-8,10-11,17H2,1-2H3
InChIKeySEBZLAHYCHZLCJ-UHFFFAOYSA-N
MW250.36 g/mol
LogP2.78
Rot. Bonds4

About 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine

2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine (PubChem CID 82768565) has the molecular formula C15H23FN2 and a molecular weight of 250.36 g/mol. Its IUPAC name is 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine
PubChem CID82768565
Molecular FormulaC15H23FN2
Molecular Weight250.36 g/mol
Exact Mass250.18
IUPAC Name2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine
SMILESCN(Cc1cccc(F)c1)CC1(C)CCCC1N
InChIInChI=1S/C15H23FN2/c1-15(8-4-7-14(15)17)11-18(2)10-12-5-3-6-13(16)9-12/h3,5-6,9,14H,4,7-8,10-11,17H2,1-2H3
InChIKeySEBZLAHYCHZLCJ-UHFFFAOYSA-N
XLogP2.78
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[benzyl(methyl)amino]methyl]-2-methylcyclopentan-1-amine
CID 82768563
2-[[(4-chlorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine
CID 82767316
2-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]cyclopentan-1-amine
CID 82768478
1-[[(3-fluorophenyl)methyl-methylamino]methyl]cyclopentane-1-carbaldehyde
CID 55050971
1-(2-amino-1-methylcyclopentyl)-2-(3-fluorophenyl)ethanone
CID 116607121
2-amino-N-[(3-fluorophenyl)methyl]-1-methylcyclopentane-1-carboxamide
CID 82763607
2-[(3-fluorophenyl)methyl-methylamino]cyclohexan-1-ol
CID 60714854
3-ethoxy-1-[[(3-fluorophenyl)methyl-methylamino]methyl]-2,2-dimethylcyclobutan-1-amine
CID 114830256
5-[[(3-fluorophenyl)methyl-methylamino]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79866448
N-[(3-ethylpiperidin-3-yl)methyl]-1-(3-fluorophenyl)-N-methylmethanamine
CID 63133198
2-chloro-N-[(3-fluorophenyl)methyl]-N-methylethanamine
CID 61286506
[3-[[(3-fluorophenyl)methyl-methylamino]methyl]oxolan-3-yl]methanol
CID 62271267

Frequently Asked Questions

What is the IUPAC name of 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine?
The IUPAC name of 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine (CID 82768565) is 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine is CN(Cc1cccc(F)c1)CC1(C)CCCC1N.
What is the InChIKey of 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine?
The InChIKey is SEBZLAHYCHZLCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2/c1-15(8-4-7-14(15)17)11-18(2)10-12-5-3-6-13(16)9-12/h3,5-6,9,14H,4,7-8,10-11,17H2,1-2H3.
What are the key properties of 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine?
2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine has a molecular weight of 250.36 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 82768565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).