N-propyl-6-prop-2-ynoxypyridin-2-amine

C11H14N2O — CID 80861470

IUPACN-propyl-6-prop-2-ynoxypyridin-2-amine
SMILESC#CCOc1cccc(NCCC)n1
InChIInChI=1S/C11H14N2O/c1-3-8-12-10-6-5-7-11(13-10)14-9-4-2/h2,5-7H,3,8-9H2,1H3,(H,12,13)
InChIKeyFQPJSTHWCLXVSW-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.92
Rot. Bonds5

About N-propyl-6-prop-2-ynoxypyridin-2-amine

N-propyl-6-prop-2-ynoxypyridin-2-amine (PubChem CID 80861470) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is N-propyl-6-prop-2-ynoxypyridin-2-amine.

Molecular Properties

Compound NameN-propyl-6-prop-2-ynoxypyridin-2-amine
PubChem CID80861470
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC NameN-propyl-6-prop-2-ynoxypyridin-2-amine
SMILESC#CCOc1cccc(NCCC)n1
InChIInChI=1S/C11H14N2O/c1-3-8-12-10-6-5-7-11(13-10)14-9-4-2/h2,5-7H,3,8-9H2,1H3,(H,12,13)
InChIKeyFQPJSTHWCLXVSW-UHFFFAOYSA-N
XLogP1.92
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

6-prop-2-enoxy-N-propylpyridin-2-amine
CID 80868454
6-(3-methylbutoxy)-N-propylpyridin-2-amine
CID 80859395
6-[(E)-but-2-enoxy]-N-propylpyridin-2-amine
CID 80872267
6-[(2-methylpropan-2-yl)oxy]-N-propylpyridin-2-amine
CID 80861017
6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 80871017
6-ethoxy-N-hex-5-ynylpyridin-2-amine
CID 106214456
6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine
CID 80860049
N,2-dipropyl-6-prop-2-ynoxypyrimidin-4-amine
CID 80949834
N-propyl-6-quinolin-8-yloxypyridin-2-amine
CID 80874687
N-(2-chloroethyl)-6-ethoxypyridin-2-amine
CID 65029665
6-(4-chloro-3,5-dimethylphenoxy)-N-propylpyridin-2-amine
CID 80875365
6-butoxy-N-ethylpyridin-2-amine
CID 80867318

Frequently Asked Questions

What is the IUPAC name of N-propyl-6-prop-2-ynoxypyridin-2-amine?
The IUPAC name of N-propyl-6-prop-2-ynoxypyridin-2-amine (CID 80861470) is N-propyl-6-prop-2-ynoxypyridin-2-amine.
What is the SMILES notation for N-propyl-6-prop-2-ynoxypyridin-2-amine?
The canonical SMILES for N-propyl-6-prop-2-ynoxypyridin-2-amine is C#CCOc1cccc(NCCC)n1.
What is the InChIKey of N-propyl-6-prop-2-ynoxypyridin-2-amine?
The InChIKey is FQPJSTHWCLXVSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-3-8-12-10-6-5-7-11(13-10)14-9-4-2/h2,5-7H,3,8-9H2,1H3,(H,12,13).
What are the key properties of N-propyl-6-prop-2-ynoxypyridin-2-amine?
N-propyl-6-prop-2-ynoxypyridin-2-amine has a molecular weight of 190.25 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-6-prop-2-ynoxypyridin-2-amine is sourced from PubChem (CID 80861470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).