3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide

C11H17N3O — CID 39241658

IUPAC3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide
SMILESCCN(Cc1ccccn1)C(=O)CCN
InChIInChI=1S/C11H17N3O/c1-2-14(11(15)6-7-12)9-10-5-3-4-8-13-10/h3-5,8H,2,6-7,9,12H2,1H3
InChIKeyRVABBVGWAJUTEB-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.78
Rot. Bonds5

About 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide

3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide (PubChem CID 39241658) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide.

Molecular Properties

Compound Name3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide
PubChem CID39241658
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide
SMILESCCN(Cc1ccccn1)C(=O)CCN
InChIInChI=1S/C11H17N3O/c1-2-14(11(15)6-7-12)9-10-5-3-4-8-13-10/h3-5,8H,2,6-7,9,12H2,1H3
InChIKeyRVABBVGWAJUTEB-UHFFFAOYSA-N
XLogP0.78
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(pyridin-2-ylmethyl)-3-sulfanylpropanamide
CID 107032625
3-[[2-(diethylamino)-2-oxoethyl]-(pyridin-2-ylmethyl)amino]propanoic acid
CID 82327071
4-amino-N-[(3-methylphenyl)methyl]-N-(pyridin-2-ylmethyl)butanamide
CID 119878034
2-(benzimidazol-1-yl)-N-ethyl-N-(pyridin-2-ylmethyl)acetamide
CID 166221588
N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide
CID 61242673
N-ethyl-3-methyl-N-(pyridin-2-ylmethyl)-2-sulfanylbutanamide
CID 107032618
N-ethyl-2-fluoro-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 114037745
5-amino-N-ethyl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 81316352
N-ethyl-2-iodo-3-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 103741244
2-amino-N-ethyl-3-phenyl-N-(pyridin-2-ylmethyl)propanamide;dihydrochloride
CID 119885181
3-amino-N-[(2-chlorophenyl)methyl]-N-ethylpropanamide
CID 60938834
2-amino-N-ethyl-2-(1-methylpyrazol-4-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 115290980

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide?
The IUPAC name of 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide (CID 39241658) is 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide.
What is the SMILES notation for 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide?
The canonical SMILES for 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide is CCN(Cc1ccccn1)C(=O)CCN.
What is the InChIKey of 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide?
The InChIKey is RVABBVGWAJUTEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-2-14(11(15)6-7-12)9-10-5-3-4-8-13-10/h3-5,8H,2,6-7,9,12H2,1H3.
What are the key properties of 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide?
3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide has a molecular weight of 207.28 g/mol, XLogP of 0.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-N-(pyridin-2-ylmethyl)propanamide is sourced from PubChem (CID 39241658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).