N-formyl-N-(4-methyl-2-pyridinyl)propanamide

C10H12N2O2 — CID 175611443

IUPACN-formyl-N-(4-methyl-2-pyridinyl)propanamide
SMILESCCC(=O)N(C=O)c1cc(C)ccn1
InChIInChI=1S/C10H12N2O2/c1-3-10(14)12(7-13)9-6-8(2)4-5-11-9/h4-7H,3H2,1-2H3
InChIKeyKWVKMOREHHIDBA-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.29
Rot. Bonds3

About N-formyl-N-(4-methyl-2-pyridinyl)propanamide

N-formyl-N-(4-methyl-2-pyridinyl)propanamide (PubChem CID 175611443) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is N-formyl-N-(4-methyl-2-pyridinyl)propanamide.

Molecular Properties

Compound NameN-formyl-N-(4-methyl-2-pyridinyl)propanamide
PubChem CID175611443
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC NameN-formyl-N-(4-methyl-2-pyridinyl)propanamide
SMILESCCC(=O)N(C=O)c1cc(C)ccn1
InChIInChI=1S/C10H12N2O2/c1-3-10(14)12(7-13)9-6-8(2)4-5-11-9/h4-7H,3H2,1-2H3
InChIKeyKWVKMOREHHIDBA-UHFFFAOYSA-N
XLogP1.29
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-formyl-N-(4-methyl-2-pyridinyl)propanamide?
The IUPAC name of N-formyl-N-(4-methyl-2-pyridinyl)propanamide (CID 175611443) is N-formyl-N-(4-methyl-2-pyridinyl)propanamide.
What is the SMILES notation for N-formyl-N-(4-methyl-2-pyridinyl)propanamide?
The canonical SMILES for N-formyl-N-(4-methyl-2-pyridinyl)propanamide is CCC(=O)N(C=O)c1cc(C)ccn1.
What is the InChIKey of N-formyl-N-(4-methyl-2-pyridinyl)propanamide?
The InChIKey is KWVKMOREHHIDBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-3-10(14)12(7-13)9-6-8(2)4-5-11-9/h4-7H,3H2,1-2H3.
What are the key properties of N-formyl-N-(4-methyl-2-pyridinyl)propanamide?
N-formyl-N-(4-methyl-2-pyridinyl)propanamide has a molecular weight of 192.22 g/mol, XLogP of 1.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-formyl-N-(4-methyl-2-pyridinyl)propanamide is sourced from PubChem (CID 175611443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).