2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide

C14H23N3O — CID 114932033

IUPAC2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide
SMILESCCC(CC)(CN)C(=O)Nc1cc(C)cc(C)n1
InChIInChI=1S/C14H23N3O/c1-5-14(6-2,9-15)13(18)17-12-8-10(3)7-11(4)16-12/h7-8H,5-6,9,15H2,1-4H3,(H,16,17,18)
InChIKeyRGPGGHYUMZBMTA-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.40
Rot. Bonds5

About 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide

2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide (PubChem CID 114932033) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide
PubChem CID114932033
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide
SMILESCCC(CC)(CN)C(=O)Nc1cc(C)cc(C)n1
InChIInChI=1S/C14H23N3O/c1-5-14(6-2,9-15)13(18)17-12-8-10(3)7-11(4)16-12/h7-8H,5-6,9,15H2,1-4H3,(H,16,17,18)
InChIKeyRGPGGHYUMZBMTA-UHFFFAOYSA-N
XLogP2.40
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4,6-dimethyl-2-pyridinyl)amino]-2,2-diethyl-4-oxobutanoic acid
CID 114931869
6-chloro-N-(4,6-dimethyl-2-pyridinyl)-2,2,3,3,4,4,5,5,6,6-decafluorohexanamide
CID 4613266
2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide
CID 4199160
CID 10084917
CID 10084917
N-(4,6-dimethyl-2-pyridinyl)hexanamide
CID 5075598
2-(aminomethyl)-2-ethyl-N-(5-propyl-1H-pyrazol-3-yl)butanamide
CID 113433572
N-(4,6-dimethyl-2-pyridinyl)nonanamide
CID 4047413
2-(aminomethyl)-N-(2-bromo-5-methylphenyl)-2-ethylbutanamide
CID 82757220
6-amino-N-(4,6-dimethyl-2-pyridinyl)-4-methylhexanamide
CID 114932264
2-(aminomethyl)-N-(5-chloro-2-pyridinyl)-2-ethylbutanamide
CID 113308872
2-(aminomethyl)-2-ethyl-N-(2,4,5-trifluorophenyl)butanamide
CID 62815380
N-(4,6-dimethyl-2-pyridinyl)-2-(4-methylphenyl)acetamide
CID 17148768

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide?
The IUPAC name of 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide (CID 114932033) is 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide?
The canonical SMILES for 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide is CCC(CC)(CN)C(=O)Nc1cc(C)cc(C)n1.
What is the InChIKey of 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide?
The InChIKey is RGPGGHYUMZBMTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-5-14(6-2,9-15)13(18)17-12-8-10(3)7-11(4)16-12/h7-8H,5-6,9,15H2,1-4H3,(H,16,17,18).
What are the key properties of 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide?
2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide has a molecular weight of 249.36 g/mol, XLogP of 2.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(4,6-dimethyl-2-pyridinyl)-2-ethylbutanamide is sourced from PubChem (CID 114932033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).