3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine

C12H16F2N2 — CID 107419343

IUPAC3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine
SMILESCC1CCCC1CNc1ncc(F)cc1F
InChIInChI=1S/C12H16F2N2/c1-8-3-2-4-9(8)6-15-12-11(14)5-10(13)7-16-12/h5,7-9H,2-4,6H2,1H3,(H,15,16)
InChIKeyNOAUKZDJRORKGX-UHFFFAOYSA-N
MW226.27 g/mol
LogP3.21
Rot. Bonds3

About 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine

3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine (PubChem CID 107419343) has the molecular formula C12H16F2N2 and a molecular weight of 226.27 g/mol. Its IUPAC name is 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine
PubChem CID107419343
Molecular FormulaC12H16F2N2
Molecular Weight226.27 g/mol
Exact Mass226.13
IUPAC Name3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine
SMILESCC1CCCC1CNc1ncc(F)cc1F
InChIInChI=1S/C12H16F2N2/c1-8-3-2-4-9(8)6-15-12-11(14)5-10(13)7-16-12/h5,7-9H,2-4,6H2,1H3,(H,15,16)
InChIKeyNOAUKZDJRORKGX-UHFFFAOYSA-N
XLogP3.21
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.27
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(chloromethyl)cyclopentyl]methyl]-3,5-difluoropyridin-2-amine
CID 112676581
5-fluoro-2-[(2-methylcyclopentyl)methylamino]pyridine-3-carboxylic acid
CID 114034559
[2-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 112675954
5-fluoro-N-[(2-methylcyclopentyl)methyl]pyrimidin-2-amine
CID 107419346
4-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 106130548
3-methyl-2-N-[(2-methylcyclopentyl)methyl]pyridine-2,5-diamine
CID 107416546
3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol
CID 112675958
5-chloro-3-fluoro-N-[(2-methylcyclopropyl)methyl]pyridin-2-amine
CID 115681742
5-methyl-2-N-[(2-methylcyclohexyl)methyl]pyridine-2,3-diamine
CID 66278219
4-N-[(2-methylcyclopentyl)methyl]pyrimidine-4,5-diamine
CID 107416529
5-amino-2-[(2-methylcyclopentyl)methylamino]pyridine-3-carboxylic acid
CID 114047478
N-[[2-(aminomethyl)cyclohexyl]methyl]-5-bromo-3-fluoropyridin-2-amine
CID 114047966

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine?
The IUPAC name of 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine (CID 107419343) is 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine.
What is the SMILES notation for 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine?
The canonical SMILES for 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine is CC1CCCC1CNc1ncc(F)cc1F.
What is the InChIKey of 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine?
The InChIKey is NOAUKZDJRORKGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F2N2/c1-8-3-2-4-9(8)6-15-12-11(14)5-10(13)7-16-12/h5,7-9H,2-4,6H2,1H3,(H,15,16).
What are the key properties of 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine?
3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine has a molecular weight of 226.27 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-[(2-methylcyclopentyl)methyl]pyridin-2-amine is sourced from PubChem (CID 107419343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).