4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine

C11H17N3 — CID 62472223

IUPAC4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine
SMILESCNc1cc(CN(C)C2CC2)ccn1
InChIInChI=1S/C11H17N3/c1-12-11-7-9(5-6-13-11)8-14(2)10-3-4-10/h5-7,10H,3-4,8H2,1-2H3,(H,12,13)
InChIKeyLNSVHFFVIHNQEB-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.72
Rot. Bonds4

About 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine

4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine (PubChem CID 62472223) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine
PubChem CID62472223
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine
SMILESCNc1cc(CN(C)C2CC2)ccn1
InChIInChI=1S/C11H17N3/c1-12-11-7-9(5-6-13-11)8-14(2)10-3-4-10/h5-7,10H,3-4,8H2,1-2H3,(H,12,13)
InChIKeyLNSVHFFVIHNQEB-UHFFFAOYSA-N
XLogP1.72
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine?
The IUPAC name of 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine (CID 62472223) is 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine is CNc1cc(CN(C)C2CC2)ccn1.
What is the InChIKey of 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine?
The InChIKey is LNSVHFFVIHNQEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-12-11-7-9(5-6-13-11)8-14(2)10-3-4-10/h5-7,10H,3-4,8H2,1-2H3,(H,12,13).
What are the key properties of 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine?
4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine has a molecular weight of 191.28 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 62472223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).