2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide

C11H15N3O2 — CID 90865597

IUPAC2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide
SMILESCC(C)(C)C(=O)Nc1cccc(CN=O)n1
InChIInChI=1S/C11H15N3O2/c1-11(2,3)10(15)14-9-6-4-5-8(13-9)7-12-16/h4-6H,7H2,1-3H3,(H,13,14,15)
InChIKeyBNYBQODNIIWTHU-UHFFFAOYSA-N
MW221.26 g/mol
LogP2.33
Rot. Bonds3

About 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide

2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide (PubChem CID 90865597) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide
PubChem CID90865597
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide
SMILESCC(C)(C)C(=O)Nc1cccc(CN=O)n1
InChIInChI=1S/C11H15N3O2/c1-11(2,3)10(15)14-9-6-4-5-8(13-9)7-12-16/h4-6H,7H2,1-3H3,(H,13,14,15)
InChIKeyBNYBQODNIIWTHU-UHFFFAOYSA-N
XLogP2.33
TPSA71.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(azidomethyl)-2-pyridinyl]-2,2-dimethylpropanamide
CID 15541065
2,2-dimethyl-N-(6-phosphanyl-2-pyridinyl)propanamide
CID 70898428
N-[6-[(4-fluorophenyl)methoxymethyl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 68842438
3-chloro-N-[6-[(3-chloro-2,2-dimethylpropanoyl)amino]-2-pyridinyl]-2,2-dimethylpropanamide
CID 2767546
N-[6-bis(3,5-diethylphenyl)phosphanyl-2-pyridinyl]-2,2-dimethylpropanamide
CID 87356862
2,2-dimethyl-N-[6-[3-[(3-methylphenyl)carbamoylamino]propyl]-2-pyridinyl]propanamide
CID 143998085
N-(6-chloro-5-ethyl-2-pyridinyl)-2,2-dimethylpropanamide
CID 59272532
1-[2-amino-6-(bromomethyl)-2H-pyridin-1-yl]-2,2-dimethylpropan-1-one;N-[6-(azidomethyl)-2-pyridinyl]-2,2-dimethylpropanamide
CID 162014396
1-N,3-N,5-N-tris(6-ethyl-2-pyridinyl)benzene-1,3,5-tricarboxamide
CID 11329889
N-(6-ethyl-2-pyridinyl)butanamide
CID 66596264
N-tert-butyl-1-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]methanimine oxide
CID 59013576
N-[6-(aminooxymethyl)-2-pyridinyl]-3,3-dimethoxy-2,2-dimethylpropanamide
CID 89349742

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide (CID 90865597) is 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide is CC(C)(C)C(=O)Nc1cccc(CN=O)n1.
What is the InChIKey of 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide?
The InChIKey is BNYBQODNIIWTHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-11(2,3)10(15)14-9-6-4-5-8(13-9)7-12-16/h4-6H,7H2,1-3H3,(H,13,14,15).
What are the key properties of 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide?
2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide has a molecular weight of 221.26 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[6-(nitrosomethyl)-2-pyridinyl]propanamide is sourced from PubChem (CID 90865597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).