N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine

C14H24N2O2 — CID 62950387

IUPACN-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine
SMILESCOCCOc1ccc(NCCC(C)(C)C)cn1
InChIInChI=1S/C14H24N2O2/c1-14(2,3)7-8-15-12-5-6-13(16-11-12)18-10-9-17-4/h5-6,11,15H,7-10H2,1-4H3
InChIKeyPVUVNBSXTRYTRB-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.95
Rot. Bonds7

About N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine

N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine (PubChem CID 62950387) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine.

Molecular Properties

Compound NameN-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine
PubChem CID62950387
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine
SMILESCOCCOc1ccc(NCCC(C)(C)C)cn1
InChIInChI=1S/C14H24N2O2/c1-14(2,3)7-8-15-12-5-6-13(16-11-12)18-10-9-17-4/h5-6,11,15H,7-10H2,1-4H3
InChIKeyPVUVNBSXTRYTRB-UHFFFAOYSA-N
XLogP2.95
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.95
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

N'-tert-butyl-N-[6-(2-methoxyethoxy)-3-pyridinyl]ethane-1,2-diamine
CID 107444977
6-(2-methoxyethoxy)-N-(3-methylbutyl)pyridin-3-amine
CID 43688362
6-(2-methoxyethoxy)-N-(2-phenylethyl)pyridin-3-amine
CID 43688348
6-(2-methoxyethoxy)-N-prop-2-ynylpyridin-3-amine
CID 63951273
2-bromo-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
CID 100773616
N-[(2,6-difluorophenyl)methyl]-6-(2-methoxyethoxy)pyridin-3-amine
CID 43688333
N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide
CID 64591758
6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine
CID 103347504
2,2,3,3-tetrafluoro-N-[6-(2-methoxyethoxy)-3-pyridinyl]propanamide
CID 103732741
(2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide
CID 100774730
6-methoxy-N-(4,4,4-trifluorobutyl)pyridin-3-amine
CID 115513408
2-fluoro-4-[[[6-(2-methoxyethoxy)-3-pyridinyl]amino]methyl]phenol
CID 107685440

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine?
The IUPAC name of N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine (CID 62950387) is N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine.
What is the SMILES notation for N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine?
The canonical SMILES for N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine is COCCOc1ccc(NCCC(C)(C)C)cn1.
What is the InChIKey of N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine?
The InChIKey is PVUVNBSXTRYTRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-14(2,3)7-8-15-12-5-6-13(16-11-12)18-10-9-17-4/h5-6,11,15H,7-10H2,1-4H3.
What are the key properties of N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine?
N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine has a molecular weight of 252.36 g/mol, XLogP of 2.95, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutyl)-6-(2-methoxyethoxy)pyridin-3-amine is sourced from PubChem (CID 62950387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).