6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine

C13H23N3 — CID 83122832

IUPAC6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine
SMILESCC(C)CCN(C)c1ccc(C(C)N)nc1
InChIInChI=1S/C13H23N3/c1-10(2)7-8-16(4)12-5-6-13(11(3)14)15-9-12/h5-6,9-11H,7-8,14H2,1-4H3
InChIKeyCOCNYPTWNWNOAR-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.58
Rot. Bonds5

About 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine

6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine (PubChem CID 83122832) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine.

Molecular Properties

Compound Name6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine
PubChem CID83122832
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine
SMILESCC(C)CCN(C)c1ccc(C(C)N)nc1
InChIInChI=1S/C13H23N3/c1-10(2)7-8-16(4)12-5-6-13(11(3)14)15-9-12/h5-6,9-11H,7-8,14H2,1-4H3
InChIKeyCOCNYPTWNWNOAR-UHFFFAOYSA-N
XLogP2.58
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(1S)-1-aminoethyl]-N-methyl-N-(2-methylbutyl)pyridin-3-amine
CID 83123142
6-[(1R)-1-aminoethyl]-N-(3-methoxypropyl)-N-methylpyridin-3-amine
CID 83126972
6-(1-aminoethyl)-N-methyl-N-(2-pyridin-2-ylethyl)pyridin-3-amine
CID 83122719
6-(1-aminoethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-3-amine
CID 83127479
6-[(1R)-1-aminoethyl]-N,N-dimethylpyridin-3-amine
CID 83122052
N'-[6-(1-aminoethyl)-3-pyridinyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 83122520
6-[1-(ethylamino)propyl]-N-methyl-N-(3-methylbutyl)pyridin-3-amine
CID 112584276
6-(1-aminoethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyridin-3-amine
CID 83122822
6-[(1R)-1-aminoethyl]-N-methyl-N-(2-methylprop-2-enyl)pyridin-3-amine
CID 104868613
N-methyl-N-(3-methylbutyl)-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939346
6-(1-aminoethyl)-N-methyl-N-(pyridin-4-ylmethyl)pyridin-3-amine
CID 83121898
1-[[6-[(1R)-1-aminoethyl]-3-pyridinyl]-methylamino]-3-methoxypropan-2-ol
CID 83121930

Frequently Asked Questions

What is the IUPAC name of 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine?
The IUPAC name of 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine (CID 83122832) is 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine.
What is the SMILES notation for 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine?
The canonical SMILES for 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine is CC(C)CCN(C)c1ccc(C(C)N)nc1.
What is the InChIKey of 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine?
The InChIKey is COCNYPTWNWNOAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-10(2)7-8-16(4)12-5-6-13(11(3)14)15-9-12/h5-6,9-11H,7-8,14H2,1-4H3.
What are the key properties of 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine?
6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine has a molecular weight of 221.35 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)pyridin-3-amine is sourced from PubChem (CID 83122832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).