3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine

C13H22N2O2 — CID 113450392

IUPAC3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine
SMILESCC(C)OCCNc1ncccc1OC(C)C
InChIInChI=1S/C13H22N2O2/c1-10(2)16-9-8-15-13-12(17-11(3)4)6-5-7-14-13/h5-7,10-11H,8-9H2,1-4H3,(H,14,15)
InChIKeyQPUDMSPOEGLSMU-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.71
Rot. Bonds7

About 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine

3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine (PubChem CID 113450392) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine
PubChem CID113450392
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine
SMILESCC(C)OCCNc1ncccc1OC(C)C
InChIInChI=1S/C13H22N2O2/c1-10(2)16-9-8-15-13-12(17-11(3)4)6-5-7-14-13/h5-7,10-11H,8-9H2,1-4H3,(H,14,15)
InChIKeyQPUDMSPOEGLSMU-UHFFFAOYSA-N
XLogP2.71
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-N-(3-propan-2-yloxy-2-pyridinyl)pentane-1,4-diamine
CID 106127389
N-(3-methyl-2-propan-2-ylbutyl)-3-propan-2-yloxypyridin-2-amine
CID 102914136
N,N-dimethyl-2-[(3-propan-2-yloxy-2-pyridinyl)amino]ethanesulfonamide
CID 106338931
N-[2-(5-chlorothiophen-2-yl)ethyl]-3-propan-2-yloxypyridin-2-amine
CID 106048859
N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine
CID 106900068
N-[2-(1-methylpyrazol-3-yl)ethyl]-3-propan-2-yloxypyridin-2-amine
CID 106105523
3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine
CID 114169605
3-ethyl-1-[(3-propan-2-yloxy-2-pyridinyl)amino]pentan-2-ol
CID 106287839
N-(2-methylpentan-3-yl)-3-propan-2-yloxypyridin-2-amine
CID 113370845
N-[(3-fluorophenyl)methyl]-3-propan-2-yloxypyridin-2-amine
CID 112547893
3-(difluoromethoxy)-N-(3-methoxypropyl)pyridin-2-amine
CID 75450414
3-N-(2-propan-2-yloxyethyl)pyridine-2,3-diamine
CID 104758771

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine?
The IUPAC name of 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine (CID 113450392) is 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine.
What is the SMILES notation for 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine?
The canonical SMILES for 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine is CC(C)OCCNc1ncccc1OC(C)C.
What is the InChIKey of 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine?
The InChIKey is QPUDMSPOEGLSMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-10(2)16-9-8-15-13-12(17-11(3)4)6-5-7-14-13/h5-7,10-11H,8-9H2,1-4H3,(H,14,15).
What are the key properties of 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine?
3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine has a molecular weight of 238.33 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine is sourced from PubChem (CID 113450392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).