2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine

C14H21FN2 — CID 81364867

IUPAC2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine
SMILESC[C@@H](NC1CCCC1CN)c1cccc(F)c1
InChIInChI=1S/C14H21FN2/c1-10(11-4-2-6-13(15)8-11)17-14-7-3-5-12(14)9-16/h2,4,6,8,10,12,14,17H,3,5,7,9,16H2,1H3/t10-,12?,14?/m1/s1
InChIKeySKDNVWFAPUXQGS-PWQPVHBWSA-N
MW236.33 g/mol
LogP2.60
Rot. Bonds4

About 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine

2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine (PubChem CID 81364867) has the molecular formula C14H21FN2 and a molecular weight of 236.33 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine
PubChem CID81364867
Molecular FormulaC14H21FN2
Molecular Weight236.33 g/mol
Exact Mass236.17
IUPAC Name2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine
SMILESC[C@@H](NC1CCCC1CN)c1cccc(F)c1
InChIInChI=1S/C14H21FN2/c1-10(11-4-2-6-13(15)8-11)17-14-7-3-5-12(14)9-16/h2,4,6,8,10,12,14,17H,3,5,7,9,16H2,1H3/t10-,12?,14?/m1/s1
InChIKeySKDNVWFAPUXQGS-PWQPVHBWSA-N
XLogP2.60
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-[(1S)-1-(3-fluorophenyl)ethyl]cyclohexan-1-amine
CID 81364942
trans-(1R,2R)-2-[1-(3-fluorophenyl)ethylamino]cyclopentan-1-ol
CID 102733281
2-tert-butyl-N-[(1S)-1-(3-fluorophenyl)ethyl]cyclohexan-1-amine
CID 81364809
2-tert-butyl-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclohexan-1-amine
CID 81369390
2-tert-butyl-N-[1-(3-fluorophenyl)ethyl]cyclohexan-1-amine
CID 43078909
N-[(1S)-1-(3-fluorophenyl)ethyl]-2,3-dimethylcyclohexan-1-amine
CID 81365854
N-[1-(3-fluorophenyl)ethyl]-2-methoxycyclopentan-1-amine
CID 55033361
2-[[(1R)-1-(3-fluorophenyl)ethyl]amino]cyclopentane-1-carbonitrile
CID 81365434
N-[1-(3-fluorophenyl)ethyl]-2-propylcyclopropan-1-amine
CID 115892229
N-[1-(3-fluorophenyl)ethyl]cycloheptanamine
CID 43080032
2-(aminomethyl)-N-[(1S)-1-(4-bromophenyl)ethyl]cyclohexan-1-amine
CID 81354238
[2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol
CID 102612788

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine (CID 81364867) is 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine is C[C@@H](NC1CCCC1CN)c1cccc(F)c1.
What is the InChIKey of 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine?
The InChIKey is SKDNVWFAPUXQGS-PWQPVHBWSA-N. The full InChI is InChI=1S/C14H21FN2/c1-10(11-4-2-6-13(15)8-11)17-14-7-3-5-12(14)9-16/h2,4,6,8,10,12,14,17H,3,5,7,9,16H2,1H3/t10-,12?,14?/m1/s1.
What are the key properties of 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine?
2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine has a molecular weight of 236.33 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 81364867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).