N-(6-amino-3-pyridinyl)-N-methylbutanamide

C10H15N3O — CID 115268400

IUPACN-(6-amino-3-pyridinyl)-N-methylbutanamide
SMILESCCCC(=O)N(C)c1ccc(N)nc1
InChIInChI=1S/C10H15N3O/c1-3-4-10(14)13(2)8-5-6-9(11)12-7-8/h5-7H,3-4H2,1-2H3,(H2,11,12)
InChIKeyCBIOEMTYUDIWQD-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.43
Rot. Bonds3

About N-(6-amino-3-pyridinyl)-N-methylbutanamide

N-(6-amino-3-pyridinyl)-N-methylbutanamide (PubChem CID 115268400) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-N-methylbutanamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-N-methylbutanamide
PubChem CID115268400
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC NameN-(6-amino-3-pyridinyl)-N-methylbutanamide
SMILESCCCC(=O)N(C)c1ccc(N)nc1
InChIInChI=1S/C10H15N3O/c1-3-4-10(14)13(2)8-5-6-9(11)12-7-8/h5-7H,3-4H2,1-2H3,(H2,11,12)
InChIKeyCBIOEMTYUDIWQD-UHFFFAOYSA-N
XLogP1.43
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-N-methylbutanamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-N-methylbutanamide (CID 115268400) is N-(6-amino-3-pyridinyl)-N-methylbutanamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-N-methylbutanamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-N-methylbutanamide is CCCC(=O)N(C)c1ccc(N)nc1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-N-methylbutanamide?
The InChIKey is CBIOEMTYUDIWQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-3-4-10(14)13(2)8-5-6-9(11)12-7-8/h5-7H,3-4H2,1-2H3,(H2,11,12).
What are the key properties of N-(6-amino-3-pyridinyl)-N-methylbutanamide?
N-(6-amino-3-pyridinyl)-N-methylbutanamide has a molecular weight of 193.25 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-N-methylbutanamide is sourced from PubChem (CID 115268400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).