N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide

C12H19N3O — CID 115268124

IUPACN-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide
SMILESCCN(C(=O)CC(C)C)c1ccc(N)cn1
InChIInChI=1S/C12H19N3O/c1-4-15(12(16)7-9(2)3)11-6-5-10(13)8-14-11/h5-6,8-9H,4,7,13H2,1-3H3
InChIKeyWTSOOPYHAMDRSZ-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.06
Rot. Bonds4

About N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide

N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide (PubChem CID 115268124) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide.

Molecular Properties

Compound NameN-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide
PubChem CID115268124
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide
SMILESCCN(C(=O)CC(C)C)c1ccc(N)cn1
InChIInChI=1S/C12H19N3O/c1-4-15(12(16)7-9(2)3)11-6-5-10(13)8-14-11/h5-6,8-9H,4,7,13H2,1-3H3
InChIKeyWTSOOPYHAMDRSZ-UHFFFAOYSA-N
XLogP2.06
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-2-pyridinyl)-N-ethyl-2-phenylacetamide
CID 115268143
N-(5-amino-2-pyridinyl)-2-(2-bromophenyl)-N-ethylacetamide
CID 115268156
N-(5-amino-2-pyridinyl)-N-ethylhydroxylamine
CID 54255048
N-(5-amino-2-pyridinyl)-N-ethyloxane-4-carboxamide
CID 115268158
N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbenzamide
CID 115268133
2-N-ethyl-2-N-propan-2-ylpyridine-2,5-diamine
CID 43265505
N-(5-amino-2-pyridinyl)-5-bromo-N-ethylthiophene-2-carboxamide
CID 115273887
2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride
CID 120616165
N-(5-amino-2-pyridinyl)-5-methyl-N-propan-2-ylhexanamide
CID 115273941
N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide
CID 115273944
2-N-ethyl-2-N-methylpyridine-2,5-diamine
CID 43263136
2-(5-amino-2-pyridinyl)-N-ethyl-N-propan-2-ylacetamide;hydrochloride
CID 120620159

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide?
The IUPAC name of N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide (CID 115268124) is N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide.
What is the SMILES notation for N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide?
The canonical SMILES for N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide is CCN(C(=O)CC(C)C)c1ccc(N)cn1.
What is the InChIKey of N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide?
The InChIKey is WTSOOPYHAMDRSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-4-15(12(16)7-9(2)3)11-6-5-10(13)8-14-11/h5-6,8-9H,4,7,13H2,1-3H3.
What are the key properties of N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide?
N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide has a molecular weight of 221.30 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-pyridinyl)-N-ethyl-3-methylbutanamide is sourced from PubChem (CID 115268124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).