N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine

C11H15ClFN3 — CID 79727651

IUPACN-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine
SMILESNCC1(Nc2ncc(Cl)cc2F)CCCC1
InChIInChI=1S/C11H15ClFN3/c12-8-5-9(13)10(15-6-8)16-11(7-14)3-1-2-4-11/h5-6H,1-4,7,14H2,(H,15,16)
InChIKeyYKEVISBYEGBYDI-UHFFFAOYSA-N
MW243.71 g/mol
LogP2.56
Rot. Bonds3

About N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine

N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine (PubChem CID 79727651) has the molecular formula C11H15ClFN3 and a molecular weight of 243.71 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine
PubChem CID79727651
Molecular FormulaC11H15ClFN3
Molecular Weight243.71 g/mol
Exact Mass243.09
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine
SMILESNCC1(Nc2ncc(Cl)cc2F)CCCC1
InChIInChI=1S/C11H15ClFN3/c12-8-5-9(13)10(15-6-8)16-11(7-14)3-1-2-4-11/h5-6H,1-4,7,14H2,(H,15,16)
InChIKeyYKEVISBYEGBYDI-UHFFFAOYSA-N
XLogP2.56
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.71
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine (CID 79727651) is N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine is NCC1(Nc2ncc(Cl)cc2F)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine?
The InChIKey is YKEVISBYEGBYDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClFN3/c12-8-5-9(13)10(15-6-8)16-11(7-14)3-1-2-4-11/h5-6H,1-4,7,14H2,(H,15,16).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine?
N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine has a molecular weight of 243.71 g/mol, XLogP of 2.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-5-chloro-3-fluoropyridin-2-amine is sourced from PubChem (CID 79727651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).