2-pentoxypyridin-3-amine

C10H16N2O — CID 43274913

IUPAC2-pentoxypyridin-3-amine
SMILESCCCCCOc1ncccc1N
InChIInChI=1S/C10H16N2O/c1-2-3-4-8-13-10-9(11)6-5-7-12-10/h5-7H,2-4,8,11H2,1H3
InChIKeyISRIEFIWRBCRCN-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.23
Rot. Bonds5

About 2-pentoxypyridin-3-amine

2-pentoxypyridin-3-amine (PubChem CID 43274913) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-pentoxypyridin-3-amine.

Molecular Properties

Compound Name2-pentoxypyridin-3-amine
PubChem CID43274913
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-pentoxypyridin-3-amine
SMILESCCCCCOc1ncccc1N
InChIInChI=1S/C10H16N2O/c1-2-3-4-8-13-10-9(11)6-5-7-12-10/h5-7H,2-4,8,11H2,1H3
InChIKeyISRIEFIWRBCRCN-UHFFFAOYSA-N
XLogP2.23
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Pozanicline
CID 178052
2,6-Diamino-2'-butyloxy-3,5'-azopyridine
CID 96213
6-(2-Fluorophenoxy)pyridin-3-amine
CID 2800656
Pyridine, 5-amino-2,3'-oxydi-
CID 2800156
6-Methoxy-3-pyridinylamine
CID 81121
5-Bromo-2-methoxypyridin-3-amine
CID 44754869
6-(4-Fluorophenoxy)pyridin-3-amine
CID 421224
A-84543
CID 9794141
1-(5-Ethoxypyridin-3-yl)-1,4-diazepane
CID 22053540
3-Amino-2-(4-fluorophenoxy)pyridine
CID 2735921
5-Amino-2-butoxypyridine
CID 68314
6-Phenoxy-3-pyridinamine
CID 212856

Frequently Asked Questions

What is the IUPAC name of 2-pentoxypyridin-3-amine?
The IUPAC name of 2-pentoxypyridin-3-amine (CID 43274913) is 2-pentoxypyridin-3-amine.
What is the SMILES notation for 2-pentoxypyridin-3-amine?
The canonical SMILES for 2-pentoxypyridin-3-amine is CCCCCOc1ncccc1N.
What is the InChIKey of 2-pentoxypyridin-3-amine?
The InChIKey is ISRIEFIWRBCRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-2-3-4-8-13-10-9(11)6-5-7-12-10/h5-7H,2-4,8,11H2,1H3.
What are the key properties of 2-pentoxypyridin-3-amine?
2-pentoxypyridin-3-amine has a molecular weight of 180.25 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pentoxypyridin-3-amine is sourced from PubChem (CID 43274913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).