3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine

C10H14ClN3 — CID 65421266

IUPAC3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine
SMILESCC1CC1C(N)c1cc(Cl)cnc1N
InChIInChI=1S/C10H14ClN3/c1-5-2-7(5)9(12)8-3-6(11)4-14-10(8)13/h3-5,7,9H,2,12H2,1H3,(H2,13,14)
InChIKeyWQEYZOMCZTWPMM-UHFFFAOYSA-N
MW211.70 g/mol
LogP1.97
Rot. Bonds2

About 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine

3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine (PubChem CID 65421266) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine.

Molecular Properties

Compound Name3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine
PubChem CID65421266
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC Name3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine
SMILESCC1CC1C(N)c1cc(Cl)cnc1N
InChIInChI=1S/C10H14ClN3/c1-5-2-7(5)9(12)8-3-6(11)4-14-10(8)13/h3-5,7,9H,2,12H2,1H3,(H2,13,14)
InChIKeyWQEYZOMCZTWPMM-UHFFFAOYSA-N
XLogP1.97
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine?
The IUPAC name of 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine (CID 65421266) is 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine.
What is the SMILES notation for 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine?
The canonical SMILES for 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine is CC1CC1C(N)c1cc(Cl)cnc1N.
What is the InChIKey of 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine?
The InChIKey is WQEYZOMCZTWPMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3/c1-5-2-7(5)9(12)8-3-6(11)4-14-10(8)13/h3-5,7,9H,2,12H2,1H3,(H2,13,14).
What are the key properties of 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine?
3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine has a molecular weight of 211.70 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[amino-(2-methylcyclopropyl)methyl]-5-chloropyridin-2-amine is sourced from PubChem (CID 65421266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).