N-(4-methyl-1,2-dihydropyridin-6-yl)formamide

C7H10N2O — CID 162755982

IUPACN-(4-methyl-1,2-dihydropyridin-6-yl)formamide
SMILESCC1=CCNC(NC=O)=C1
InChIInChI=1S/C7H10N2O/c1-6-2-3-8-7(4-6)9-5-10/h2,4-5,8H,3H2,1H3,(H,9,10)
InChIKeyMSABTPXBFLYRSR-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.12
Rot. Bonds2

About N-(4-methyl-1,2-dihydropyridin-6-yl)formamide

N-(4-methyl-1,2-dihydropyridin-6-yl)formamide (PubChem CID 162755982) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is N-(4-methyl-1,2-dihydropyridin-6-yl)formamide.

Molecular Properties

Compound NameN-(4-methyl-1,2-dihydropyridin-6-yl)formamide
PubChem CID162755982
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC NameN-(4-methyl-1,2-dihydropyridin-6-yl)formamide
SMILESCC1=CCNC(NC=O)=C1
InChIInChI=1S/C7H10N2O/c1-6-2-3-8-7(4-6)9-5-10/h2,4-5,8H,3H2,1H3,(H,9,10)
InChIKeyMSABTPXBFLYRSR-UHFFFAOYSA-N
XLogP0.12
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(1-methyl-2H-pyridin-6-yl)formamide
CID 87907051
4-methyl-2-(methylamino)-2H-pyridine-1-carbaldehyde
CID 166886308

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,2-dihydropyridin-6-yl)formamide?
The IUPAC name of N-(4-methyl-1,2-dihydropyridin-6-yl)formamide (CID 162755982) is N-(4-methyl-1,2-dihydropyridin-6-yl)formamide.
What is the SMILES notation for N-(4-methyl-1,2-dihydropyridin-6-yl)formamide?
The canonical SMILES for N-(4-methyl-1,2-dihydropyridin-6-yl)formamide is CC1=CCNC(NC=O)=C1.
What is the InChIKey of N-(4-methyl-1,2-dihydropyridin-6-yl)formamide?
The InChIKey is MSABTPXBFLYRSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-6-2-3-8-7(4-6)9-5-10/h2,4-5,8H,3H2,1H3,(H,9,10).
What are the key properties of N-(4-methyl-1,2-dihydropyridin-6-yl)formamide?
N-(4-methyl-1,2-dihydropyridin-6-yl)formamide has a molecular weight of 138.17 g/mol, XLogP of 0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,2-dihydropyridin-6-yl)formamide is sourced from PubChem (CID 162755982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).