2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine

C7H8ClF2N3 — CID 118850860

IUPAC2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine
SMILESNCc1ncc(C(F)F)c(N)c1Cl
InChIInChI=1S/C7H8ClF2N3/c8-5-4(1-11)13-2-3(6(5)12)7(9)10/h2,7H,1,11H2,(H2,12,13)
InChIKeyXITAVFVIBHFLFH-UHFFFAOYSA-N
MW207.61 g/mol
LogP1.71
Rot. Bonds2

About 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine

2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine (PubChem CID 118850860) has the molecular formula C7H8ClF2N3 and a molecular weight of 207.61 g/mol. Its IUPAC name is 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine.

Molecular Properties

Compound Name2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine
PubChem CID118850860
Molecular FormulaC7H8ClF2N3
Molecular Weight207.61 g/mol
Exact Mass207.04
IUPAC Name2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine
SMILESNCc1ncc(C(F)F)c(N)c1Cl
InChIInChI=1S/C7H8ClF2N3/c8-5-4(1-11)13-2-3(6(5)12)7(9)10/h2,7H,1,11H2,(H2,12,13)
InChIKeyXITAVFVIBHFLFH-UHFFFAOYSA-N
XLogP1.71
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.61
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(bromomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine
CID 130102690
3-(aminomethyl)-2-chloro-5-(difluoromethyl)pyridin-4-amine
CID 118844985
4-amino-2-(aminomethyl)-5-(difluoromethyl)pyridine-3-carbaldehyde
CID 118805849
3-chloro-5-(difluoromethyl)-2-iodopyridin-4-amine
CID 118829021
[3-chloro-4-(difluoromethyl)-5-iodo-2-pyridinyl]methanamine
CID 118808483
6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol
CID 118825681
[5-(difluoromethyl)-3,4-diiodo-2-pyridinyl]methanamine
CID 118848069
methyl 2-[2-(aminomethyl)-3-chloro-5-(difluoromethyl)-4-pyridinyl]acetate
CID 134663917
2-(aminomethyl)-5-(difluoromethyl)-4-nitropyridin-3-amine
CID 134663951
6-(aminomethyl)-4-(difluoromethyl)pyridine-2,5-diamine
CID 118836943
[4-bromo-5-(difluoromethyl)-3-fluoro-2-pyridinyl]methanamine
CID 118803013
[3-chloro-5-(difluoromethyl)-2-fluoro-4-pyridinyl]methanamine
CID 118829918

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine?
The IUPAC name of 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine (CID 118850860) is 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine.
What is the SMILES notation for 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine?
The canonical SMILES for 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine is NCc1ncc(C(F)F)c(N)c1Cl.
What is the InChIKey of 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine?
The InChIKey is XITAVFVIBHFLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClF2N3/c8-5-4(1-11)13-2-3(6(5)12)7(9)10/h2,7H,1,11H2,(H2,12,13).
What are the key properties of 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine?
2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine has a molecular weight of 207.61 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine is sourced from PubChem (CID 118850860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).