(1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol

C12H20N2O — CID 124502320

IUPAC(1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol
SMILESCCCNc1ccc([C@H](O)CC)c(C)n1
InChIInChI=1S/C12H20N2O/c1-4-8-13-12-7-6-10(9(3)14-12)11(15)5-2/h6-7,11,15H,4-5,8H2,1-3H3,(H,13,14)/t11-/m1/s1
InChIKeyDEDAPRSRIOATLL-LLVKDONJSA-N
MW208.30 g/mol
LogP2.66
Rot. Bonds5

About (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol

(1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol (PubChem CID 124502320) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol
PubChem CID124502320
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name(1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol
SMILESCCCNc1ccc([C@H](O)CC)c(C)n1
InChIInChI=1S/C12H20N2O/c1-4-8-13-12-7-6-10(9(3)14-12)11(15)5-2/h6-7,11,15H,4-5,8H2,1-3H3,(H,13,14)/t11-/m1/s1
InChIKeyDEDAPRSRIOATLL-LLVKDONJSA-N
XLogP2.66
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol 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

(1R)-1-(6-amino-2-methyl-3-pyridinyl)propan-1-ol
CID 124502258
ethane;(1S)-1-(2-methyl-3-pyridinyl)propan-1-ol
CID 144739559
6-methyl-N-propyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
CID 91828107
5-[(1R)-1-aminopropyl]-N-tert-butyl-6-methylpyridin-2-amine
CID 124502702
1-(2,6-dimethyl-3-pyridinyl)pentan-1-ol
CID 105085207
(2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol
CID 126988382
6-N-pentan-3-yl-2-N-propylpyridine-2,6-diamine
CID 80770551
5-(aminomethyl)-4,6-dimethyl-N-propylpyridin-2-amine
CID 130817101
1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol
CID 105085795
(1R)-1-[6-(propylamino)-3-pyridinyl]ethanol
CID 124502793
5-(1-aminopropyl)-N-propylpyridin-2-amine
CID 102546615
3-chloro-N-pentan-3-yl-6-(propylamino)pyridine-2-carboxamide
CID 62171311

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol?
The IUPAC name of (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol (CID 124502320) is (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol.
What is the SMILES notation for (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol?
The canonical SMILES for (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol is CCCNc1ccc([C@H](O)CC)c(C)n1.
What is the InChIKey of (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol?
The InChIKey is DEDAPRSRIOATLL-LLVKDONJSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-8-13-12-7-6-10(9(3)14-12)11(15)5-2/h6-7,11,15H,4-5,8H2,1-3H3,(H,13,14)/t11-/m1/s1.
What are the key properties of (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol?
(1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol has a molecular weight of 208.30 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-methyl-6-(propylamino)-3-pyridinyl]propan-1-ol is sourced from PubChem (CID 124502320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).