5-(butoxymethyl)pyridin-2-amine

C10H16N2O — CID 62195711

IUPAC5-(butoxymethyl)pyridin-2-amine
SMILESCCCCOCc1ccc(N)nc1
InChIInChI=1S/C10H16N2O/c1-2-3-6-13-8-9-4-5-10(11)12-7-9/h4-5,7H,2-3,6,8H2,1H3,(H2,11,12)
InChIKeyYTFCVZZRBORJSP-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.98
Rot. Bonds5

About 5-(butoxymethyl)pyridin-2-amine

5-(butoxymethyl)pyridin-2-amine (PubChem CID 62195711) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 5-(butoxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(butoxymethyl)pyridin-2-amine
PubChem CID62195711
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name5-(butoxymethyl)pyridin-2-amine
SMILESCCCCOCc1ccc(N)nc1
InChIInChI=1S/C10H16N2O/c1-2-3-6-13-8-9-4-5-10(11)12-7-9/h4-5,7H,2-3,6,8H2,1H3,(H2,11,12)
InChIKeyYTFCVZZRBORJSP-UHFFFAOYSA-N
XLogP1.98
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 ≤ 51.98
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

5-[2-(2-methoxyethoxy)ethoxymethyl]pyridin-2-amine
CID 104562052
[5-(butoxymethyl)-2-pyridinyl]hydrazine
CID 62245667
2-chloro-5-(heptoxymethyl)pyridine
CID 43128041
5-(octan-2-yloxymethyl)pyridin-2-amine
CID 55044841
5-octoxypyridin-2-amine
CID 43126983
O-[(6-amino-3-pyridinyl)methyl]hydroxylamine
CID 45079509
5-[[4-(2-methoxyethyl)phenoxy]methyl]pyridin-2-amine
CID 62194855
4-(heptoxymethyl)pyridin-2-amine
CID 62465689
butoxymethylbenzene;ethane
CID 145341806
1-(butoxymethyl)-4-methylsulfanylbenzene
CID 54189278
5-(propoxymethyl)pyrazin-2-amine
CID 103058721
4-(butoxymethyl)-1,2-dimethylbenzene
CID 57131464

Frequently Asked Questions

What is the IUPAC name of 5-(butoxymethyl)pyridin-2-amine?
The IUPAC name of 5-(butoxymethyl)pyridin-2-amine (CID 62195711) is 5-(butoxymethyl)pyridin-2-amine.
What is the SMILES notation for 5-(butoxymethyl)pyridin-2-amine?
The canonical SMILES for 5-(butoxymethyl)pyridin-2-amine is CCCCOCc1ccc(N)nc1.
What is the InChIKey of 5-(butoxymethyl)pyridin-2-amine?
The InChIKey is YTFCVZZRBORJSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-2-3-6-13-8-9-4-5-10(11)12-7-9/h4-5,7H,2-3,6,8H2,1H3,(H2,11,12).
What are the key properties of 5-(butoxymethyl)pyridin-2-amine?
5-(butoxymethyl)pyridin-2-amine has a molecular weight of 180.25 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(butoxymethyl)pyridin-2-amine is sourced from PubChem (CID 62195711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).