3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol

C10H18N2O — CID 135259490

IUPAC3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol
SMILESCCCC1=C(CN)C(O)NC(C)=C1
InChIInChI=1S/C10H18N2O/c1-3-4-8-5-7(2)12-10(13)9(8)6-11/h5,10,12-13H,3-4,6,11H2,1-2H3
InChIKeySBZCQPSKYIOTPU-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.87
Rot. Bonds3

About 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol

3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol (PubChem CID 135259490) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol.

Molecular Properties

Compound Name3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol
PubChem CID135259490
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol
SMILESCCCC1=C(CN)C(O)NC(C)=C1
InChIInChI=1S/C10H18N2O/c1-3-4-8-5-7(2)12-10(13)9(8)6-11/h5,10,12-13H,3-4,6,11H2,1-2H3
InChIKeySBZCQPSKYIOTPU-UHFFFAOYSA-N
XLogP0.87
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol?
The IUPAC name of 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol (CID 135259490) is 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol.
What is the SMILES notation for 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol?
The canonical SMILES for 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol is CCCC1=C(CN)C(O)NC(C)=C1.
What is the InChIKey of 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol?
The InChIKey is SBZCQPSKYIOTPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-3-4-8-5-7(2)12-10(13)9(8)6-11/h5,10,12-13H,3-4,6,11H2,1-2H3.
What are the key properties of 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol?
3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol has a molecular weight of 182.27 g/mol, XLogP of 0.87, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-ol is sourced from PubChem (CID 135259490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).