N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline

C12H17FN2 — CID 65384455

IUPACN-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline
SMILESNCC1(Nc2cccc(F)c2)CCCC1
InChIInChI=1S/C12H17FN2/c13-10-4-3-5-11(8-10)15-12(9-14)6-1-2-7-12/h3-5,8,15H,1-2,6-7,9,14H2
InChIKeyDWBCURCUXZSYDE-UHFFFAOYSA-N
MW208.28 g/mol
LogP2.51
Rot. Bonds3

About N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline

N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline (PubChem CID 65384455) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline
PubChem CID65384455
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline
SMILESNCC1(Nc2cccc(F)c2)CCCC1
InChIInChI=1S/C12H17FN2/c13-10-4-3-5-11(8-10)15-12(9-14)6-1-2-7-12/h3-5,8,15H,1-2,6-7,9,14H2
InChIKeyDWBCURCUXZSYDE-UHFFFAOYSA-N
XLogP2.51
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N-(3-fluorophenyl)-4-methylcycloheptan-1-amine
CID 65383824
3-(aminomethyl)-N-(3-fluorophenyl)pyrrolidin-3-amine
CID 105463150
1-[1-(aminomethyl)cyclopentyl]-3-(3-fluorophenyl)urea
CID 63767680
N-[1-(aminomethyl)-4-(2-methylbutan-2-yl)cyclohexyl]-3-fluoroaniline
CID 65382978
N-[1-(aminomethyl)cyclopentyl]-3-bromo-4-fluoroaniline
CID 104776301
4-(aminomethyl)-2-ethyl-N-(3-fluorophenyl)-2-methyloxan-4-amine
CID 65385727
N-[1-(aminomethyl)cyclopentyl]-3-fluorobenzamide
CID 16740505
N-[1-(aminomethyl)cyclopentyl]-3-fluoro-5-nitroaniline
CID 63888625
[4-(3-fluoroanilino)piperidin-4-yl]methanol
CID 61243193
N-[1-(aminomethyl)cyclopentyl]pyridin-4-amine
CID 63761781
N-[1-(aminomethyl)cyclopentyl]-4-methylaniline
CID 65379015
3-(aminomethyl)-N-(4-fluorophenyl)piperidin-3-amine
CID 105480875

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline (CID 65384455) is N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline is NCC1(Nc2cccc(F)c2)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline?
The InChIKey is DWBCURCUXZSYDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2/c13-10-4-3-5-11(8-10)15-12(9-14)6-1-2-7-12/h3-5,8,15H,1-2,6-7,9,14H2.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline?
N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline has a molecular weight of 208.28 g/mol, XLogP of 2.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-3-fluoroaniline is sourced from PubChem (CID 65384455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).