6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide

C12H19N3O2 — CID 62348157

IUPAC6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide
SMILESCc1ccc(C(N)=O)c(OCCNC(C)C)n1
InChIInChI=1S/C12H19N3O2/c1-8(2)14-6-7-17-12-10(11(13)16)5-4-9(3)15-12/h4-5,8,14H,6-7H2,1-3H3,(H2,13,16)
InChIKeyQDZPTLWWOZAICK-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.87
Rot. Bonds6

About 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide

6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide (PubChem CID 62348157) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide
PubChem CID62348157
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide
SMILESCc1ccc(C(N)=O)c(OCCNC(C)C)n1
InChIInChI=1S/C12H19N3O2/c1-8(2)14-6-7-17-12-10(11(13)16)5-4-9(3)15-12/h4-5,8,14H,6-7H2,1-3H3,(H2,13,16)
InChIKeyQDZPTLWWOZAICK-UHFFFAOYSA-N
XLogP0.87
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-2-[2-(propan-2-ylamino)ethoxy]benzamide
CID 63083330
6-methyl-2-(2-pyrrolidin-3-ylethoxy)pyridine-3-carboxamide
CID 114796426
6-methyl-2-propoxypyridine-3-carboxylic acid
CID 62702426
6-methyl-2-N-(2-methylpropyl)pyridine-2,3-dicarboxamide
CID 161307485
N'-hydroxy-6-methyl-2-(4,4,4-trifluorobutoxy)pyridine-3-carboximidamide
CID 82788948
6-methyl-2-[4-(methylaminomethyl)phenoxy]pyridine-3-carboxamide
CID 106486726
2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide
CID 79868967
2,6-dimethylpyridine-3-carboxamide
CID 2824850
3-[[6-methyl-2-[(propan-2-ylamino)methyl]-3-pyridinyl]oxy]propanamide
CID 79151234
2-[2-[di(propan-2-yl)amino]ethoxy]-6-methylpyridine-3-carboximidamide
CID 115505587
2-heptoxy-N'-hydroxy-6-methylpyridine-3-carboximidamide
CID 76916332
4-[3-(propan-2-ylamino)propoxy]pyridine-2-carboxamide
CID 62347462

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide?
The IUPAC name of 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide (CID 62348157) is 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide is Cc1ccc(C(N)=O)c(OCCNC(C)C)n1.
What is the InChIKey of 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide?
The InChIKey is QDZPTLWWOZAICK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-8(2)14-6-7-17-12-10(11(13)16)5-4-9(3)15-12/h4-5,8,14H,6-7H2,1-3H3,(H2,13,16).
What are the key properties of 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide?
6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide has a molecular weight of 237.30 g/mol, XLogP of 0.87, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[2-(propan-2-ylamino)ethoxy]pyridine-3-carboxamide is sourced from PubChem (CID 62348157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).