2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol

C11H19N3O — CID 104532770

IUPAC2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol
SMILESCCCNc1cncc(N(C)CCO)c1
InChIInChI=1S/C11H19N3O/c1-3-4-13-10-7-11(9-12-8-10)14(2)5-6-15/h7-9,13,15H,3-6H2,1-2H3
InChIKeyWNAHHKAAPGBVPS-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.33
Rot. Bonds6

About 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol

2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol (PubChem CID 104532770) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol.

Molecular Properties

Compound Name2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol
PubChem CID104532770
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol
SMILESCCCNc1cncc(N(C)CCO)c1
InChIInChI=1S/C11H19N3O/c1-3-4-13-10-7-11(9-12-8-10)14(2)5-6-15/h7-9,13,15H,3-6H2,1-2H3
InChIKeyWNAHHKAAPGBVPS-UHFFFAOYSA-N
XLogP1.33
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-methyl-3-N-propyl-5-N-(3,3,3-trifluoropropyl)pyridine-3,5-diamine
CID 104535065
5-N-methyl-5-N-(2-methylsulfonylethyl)-3-N-propylpyridine-3,5-diamine
CID 113424154
N,N-dimethyl-2-[methyl-[5-(propylamino)-3-pyridinyl]amino]acetamide
CID 104532890
3-N,5-N,5-N-tripropylpyridine-3,5-diamine
CID 104532474
3-[propan-2-yl-[5-(propylamino)-3-pyridinyl]amino]propan-1-ol
CID 113423873
5-N-benzyl-5-N-methyl-3-N-propylpyridine-3,5-diamine
CID 104531987
3-[[methyl-[5-(propylamino)-3-pyridinyl]amino]methyl]cyclobutan-1-ol
CID 104535126
5-N-[(4-fluorophenyl)methyl]-5-N-methyl-3-N-propylpyridine-3,5-diamine
CID 104533243
5-N-methyl-5-N-[(1-methylpyrazol-4-yl)methyl]-3-N-propylpyridine-3,5-diamine
CID 104533339
5-N-[(2-fluorophenyl)methyl]-5-N-methyl-3-N-propylpyridine-3,5-diamine
CID 104533240
5-N-methyl-3-N-propyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine
CID 104533005
5-N-methyl-5-N-(4-methylpentan-2-yl)-3-N-propylpyridine-3,5-diamine
CID 104533765

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol?
The IUPAC name of 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol (CID 104532770) is 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol.
What is the SMILES notation for 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol?
The canonical SMILES for 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol is CCCNc1cncc(N(C)CCO)c1.
What is the InChIKey of 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol?
The InChIKey is WNAHHKAAPGBVPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-4-13-10-7-11(9-12-8-10)14(2)5-6-15/h7-9,13,15H,3-6H2,1-2H3.
What are the key properties of 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol?
2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol has a molecular weight of 209.29 g/mol, XLogP of 1.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[5-(propylamino)-3-pyridinyl]amino]ethanol is sourced from PubChem (CID 104532770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).