6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine

C11H15FN2 — CID 164652880

IUPAC6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine
SMILESCC1CC(CNc2cccc(F)n2)C1
InChIInChI=1S/C11H15FN2/c1-8-5-9(6-8)7-13-11-4-2-3-10(12)14-11/h2-4,8-9H,5-7H2,1H3,(H,13,14)
InChIKeyQGWAZHAGTUPPAY-UHFFFAOYSA-N
MW194.25 g/mol
LogP2.68
Rot. Bonds3

About 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine

6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine (PubChem CID 164652880) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine
PubChem CID164652880
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine
SMILESCC1CC(CNc2cccc(F)n2)C1
InChIInChI=1S/C11H15FN2/c1-8-5-9(6-8)7-13-11-4-2-3-10(12)14-11/h2-4,8-9H,5-7H2,1H3,(H,13,14)
InChIKeyQGWAZHAGTUPPAY-UHFFFAOYSA-N
XLogP2.68
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-[(3,5-dimethylcyclohex-3-en-1-yl)methyl]-6-fluoropyridin-2-amine
CID 103277143
N-(cyclohexylmethyl)-6-fluoropyridin-2-amine
CID 61227626
6-(5-chloro-2-fluoro-4-pyridinyl)-N-[(2,6-dimethyloxan-4-yl)methyl]pyridin-2-amine
CID 123181455
N-(2-ethylbutyl)-6-fluoropyridin-2-amine
CID 75355438
N-(2-cyclopentylethyl)-6-fluoropyridin-2-amine
CID 61228606
6-bromo-N-[(2,6-dimethyloxan-4-yl)methyl]pyridin-2-amine
CID 76740997
N-(3-ethylcyclopentyl)-6-fluoropyridin-2-amine
CID 116812943
N-(3,4-dimethylcyclohexyl)-6-fluoropyridin-2-amine
CID 64741980
N-(2,3-dimethylbutyl)-6-fluoropyridin-2-amine
CID 64597219
N-(6-fluoro-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine
CID 61229371
6-fluoro-N-[2-(1-methylcyclopropyl)ethyl]pyridin-2-amine
CID 126990897
6-fluoro-N-(3,3,5-trimethylcyclohexyl)pyridin-2-amine
CID 113228053

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine?
The IUPAC name of 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine (CID 164652880) is 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine.
What is the SMILES notation for 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine?
The canonical SMILES for 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine is CC1CC(CNc2cccc(F)n2)C1.
What is the InChIKey of 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine?
The InChIKey is QGWAZHAGTUPPAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2/c1-8-5-9(6-8)7-13-11-4-2-3-10(12)14-11/h2-4,8-9H,5-7H2,1H3,(H,13,14).
What are the key properties of 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine?
6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine has a molecular weight of 194.25 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-[(3-methylcyclobutyl)methyl]pyridin-2-amine is sourced from PubChem (CID 164652880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).