6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine

C12H21N3O — CID 81074389

IUPAC6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine
SMILESCC(C)OCCN(C)Cc1cccc(N)n1
InChIInChI=1S/C12H21N3O/c1-10(2)16-8-7-15(3)9-11-5-4-6-12(13)14-11/h4-6,10H,7-9H2,1-3H3,(H2,13,14)
InChIKeyADVQOKSHBPSLNV-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.52
Rot. Bonds6

About 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine

6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine (PubChem CID 81074389) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine
PubChem CID81074389
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine
SMILESCC(C)OCCN(C)Cc1cccc(N)n1
InChIInChI=1S/C12H21N3O/c1-10(2)16-8-7-15(3)9-11-5-4-6-12(13)14-11/h4-6,10H,7-9H2,1-3H3,(H2,13,14)
InChIKeyADVQOKSHBPSLNV-UHFFFAOYSA-N
XLogP1.52
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine?
The IUPAC name of 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine (CID 81074389) is 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine.
What is the SMILES notation for 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine?
The canonical SMILES for 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine is CC(C)OCCN(C)Cc1cccc(N)n1.
What is the InChIKey of 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine?
The InChIKey is ADVQOKSHBPSLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-10(2)16-8-7-15(3)9-11-5-4-6-12(13)14-11/h4-6,10H,7-9H2,1-3H3,(H2,13,14).
What are the key properties of 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine?
6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine has a molecular weight of 223.32 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyridin-2-amine is sourced from PubChem (CID 81074389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).