N-(cyclopropylmethyl)-5-fluoropyridin-2-amine

C9H11FN2 — CID 61313730

IUPACN-(cyclopropylmethyl)-5-fluoropyridin-2-amine
SMILESFc1ccc(NCC2CC2)nc1
InChIInChI=1S/C9H11FN2/c10-8-3-4-9(12-6-8)11-5-7-1-2-7/h3-4,6-7H,1-2,5H2,(H,11,12)
InChIKeyXGXWDHRJFVXQGF-UHFFFAOYSA-N
MW166.20 g/mol
LogP2.04
Rot. Bonds3

About N-(cyclopropylmethyl)-5-fluoropyridin-2-amine

N-(cyclopropylmethyl)-5-fluoropyridin-2-amine (PubChem CID 61313730) has the molecular formula C9H11FN2 and a molecular weight of 166.20 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-5-fluoropyridin-2-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-5-fluoropyridin-2-amine
PubChem CID61313730
Molecular FormulaC9H11FN2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC NameN-(cyclopropylmethyl)-5-fluoropyridin-2-amine
SMILESFc1ccc(NCC2CC2)nc1
InChIInChI=1S/C9H11FN2/c10-8-3-4-9(12-6-8)11-5-7-1-2-7/h3-4,6-7H,1-2,5H2,(H,11,12)
InChIKeyXGXWDHRJFVXQGF-UHFFFAOYSA-N
XLogP2.04
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-5-fluoropyridin-2-amine?
The IUPAC name of N-(cyclopropylmethyl)-5-fluoropyridin-2-amine (CID 61313730) is N-(cyclopropylmethyl)-5-fluoropyridin-2-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-5-fluoropyridin-2-amine?
The canonical SMILES for N-(cyclopropylmethyl)-5-fluoropyridin-2-amine is Fc1ccc(NCC2CC2)nc1.
What is the InChIKey of N-(cyclopropylmethyl)-5-fluoropyridin-2-amine?
The InChIKey is XGXWDHRJFVXQGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2/c10-8-3-4-9(12-6-8)11-5-7-1-2-7/h3-4,6-7H,1-2,5H2,(H,11,12).
What are the key properties of N-(cyclopropylmethyl)-5-fluoropyridin-2-amine?
N-(cyclopropylmethyl)-5-fluoropyridin-2-amine has a molecular weight of 166.20 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-5-fluoropyridin-2-amine is sourced from PubChem (CID 61313730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).