3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide

C14H23N3O — CID 115154800

IUPAC3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide
SMILESCC(C)(CN)C(=O)NCC(C)(C)c1cccnc1
InChIInChI=1S/C14H23N3O/c1-13(2,9-15)12(18)17-10-14(3,4)11-6-5-7-16-8-11/h5-8H,9-10,15H2,1-4H3,(H,17,18)
InChIKeyKXVPEKSNGZKTHH-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.46
Rot. Bonds5

About 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide

3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide (PubChem CID 115154800) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide.

Molecular Properties

Compound Name3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide
PubChem CID115154800
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide
SMILESCC(C)(CN)C(=O)NCC(C)(C)c1cccnc1
InChIInChI=1S/C14H23N3O/c1-13(2,9-15)12(18)17-10-14(3,4)11-6-5-7-16-8-11/h5-8H,9-10,15H2,1-4H3,(H,17,18)
InChIKeyKXVPEKSNGZKTHH-UHFFFAOYSA-N
XLogP1.46
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 ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)butanamide
CID 115157165
(2-methyl-2-pyridin-3-ylpropyl)urea
CID 115168843
2,2-dimethyl-3-[(2-methyl-2-pyridin-3-ylpropyl)amino]-3-oxopropanoic acid
CID 115164093
4-amino-N-(2-methyl-2-pyridin-3-ylpropyl)butanamide
CID 115155544
N-(2-methyl-2-pyridin-3-ylpropyl)-3-oxobutanamide
CID 115176671
N-(2-methyl-2-pyridin-3-ylpropyl)-3-sulfanylpropanamide
CID 115168144
4-[(2-methyl-2-pyridin-3-ylpropyl)amino]-4-oxobutanoic acid
CID 115163778
2-cyano-N-(2-methyl-2-pyridin-3-ylpropyl)acetamide
CID 115173451
2,2,4-trimethyl-4-pyridin-3-ylpentan-1-amine
CID 146668087
2-(hydroxymethyl)-N-(2-methyl-2-pyridin-3-ylpropyl)butanamide
CID 115186797
2-methyl-4-[(2-methyl-2-pyridin-3-ylpropyl)amino]-4-oxobutanoic acid
CID 115165229
3-methyl-3-N-(2-methyl-2-pyridin-3-ylpropyl)butane-1,3-diamine
CID 115135086

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide?
The IUPAC name of 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide (CID 115154800) is 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide.
What is the SMILES notation for 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide?
The canonical SMILES for 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide is CC(C)(CN)C(=O)NCC(C)(C)c1cccnc1.
What is the InChIKey of 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide?
The InChIKey is KXVPEKSNGZKTHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-13(2,9-15)12(18)17-10-14(3,4)11-6-5-7-16-8-11/h5-8H,9-10,15H2,1-4H3,(H,17,18).
What are the key properties of 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide?
3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide has a molecular weight of 249.36 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethyl-N-(2-methyl-2-pyridin-3-ylpropyl)propanamide is sourced from PubChem (CID 115154800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).