N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide

C10H14N2O — CID 142430728

IUPACN-[(5-propan-2-yl-3-pyridinyl)methyl]formamide
SMILESCC(C)c1cncc(CNC=O)c1
InChIInChI=1S/C10H14N2O/c1-8(2)10-3-9(4-11-6-10)5-12-7-13/h3-4,6-8H,5H2,1-2H3,(H,12,13)
InChIKeyOJGSFOYXIQOAKS-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.45
Rot. Bonds4

About N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide

N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide (PubChem CID 142430728) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide.

Molecular Properties

Compound NameN-[(5-propan-2-yl-3-pyridinyl)methyl]formamide
PubChem CID142430728
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC NameN-[(5-propan-2-yl-3-pyridinyl)methyl]formamide
SMILESCC(C)c1cncc(CNC=O)c1
InChIInChI=1S/C10H14N2O/c1-8(2)10-3-9(4-11-6-10)5-12-7-13/h3-4,6-8H,5H2,1-2H3,(H,12,13)
InChIKeyOJGSFOYXIQOAKS-UHFFFAOYSA-N
XLogP1.45
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(5-methyl-3-pyridinyl)methyl]formamide
CID 142430826
methyl 2-(5-propan-2-yl-3-pyridinyl)acetate
CID 20824070
3-phenyl-N-[(5-propan-2-yl-3-pyridinyl)methyl]propanamide
CID 138492197
5-propan-2-ylpyridine-3-carbaldehyde;hydrochloride
CID 155943309
N,N-dimethyl-1-(5-propan-2-yl-3-pyridinyl)methanesulfonamide
CID 158337829
3-ethenyl-5-propan-2-ylpyridine
CID 74788587
N-[(5-bromo-3-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine
CID 115580893
3-N-methyl-3-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-1-N-[3-[(5-propan-2-yl-3-pyridinyl)methylamino]propyl]benzene-1,3-dicarboxamide
CID 143752460
N-[[5-(4-chloro-1-methyl-2-oxo-3H-indol-5-yl)-3-pyridinyl]methyl]formamide
CID 90276968
N-[[4-(2-propan-2-ylphenyl)phenyl]methyl]formamide
CID 143478664
N-benzylformamide
CID 139060556
3-tert-butyl-5-propan-2-ylpyridine;ethane
CID 162747621

Frequently Asked Questions

What is the IUPAC name of N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide?
The IUPAC name of N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide (CID 142430728) is N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide.
What is the SMILES notation for N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide?
The canonical SMILES for N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide is CC(C)c1cncc(CNC=O)c1.
What is the InChIKey of N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide?
The InChIKey is OJGSFOYXIQOAKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-8(2)10-3-9(4-11-6-10)5-12-7-13/h3-4,6-8H,5H2,1-2H3,(H,12,13).
What are the key properties of N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide?
N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide has a molecular weight of 178.23 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-propan-2-yl-3-pyridinyl)methyl]formamide is sourced from PubChem (CID 142430728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).