N-formyl-N-(2-methylpropyl)formamide

C6H11NO2 — CID 18769156

IUPACN-formyl-N-(2-methylpropyl)formamide
SMILESCC(C)CN(C=O)C=O
InChIInChI=1S/C6H11NO2/c1-6(2)3-7(4-8)5-9/h4-6H,3H2,1-2H3
InChIKeyBIOFIDKMCMUGKB-UHFFFAOYSA-N
MW129.16 g/mol
LogP0.26
Rot. Bonds4

About N-formyl-N-(2-methylpropyl)formamide

N-formyl-N-(2-methylpropyl)formamide (PubChem CID 18769156) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is N-formyl-N-(2-methylpropyl)formamide.

Molecular Properties

Compound NameN-formyl-N-(2-methylpropyl)formamide
PubChem CID18769156
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC NameN-formyl-N-(2-methylpropyl)formamide
SMILESCC(C)CN(C=O)C=O
InChIInChI=1S/C6H11NO2/c1-6(2)3-7(4-8)5-9/h4-6H,3H2,1-2H3
InChIKeyBIOFIDKMCMUGKB-UHFFFAOYSA-N
XLogP0.26
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 50.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-N-formylformamide
CID 15721136
N-Methyl-N-propylformamide
CID 19070644
N-methyl-N-(2-methylpropyl)formamide
CID 53694476
N-(1-methoxy-2-methylpropyl)-N-methylformamide
CID 10701948
N-ethyl-N-(2-methylpropyl)formamide
CID 12622745
Formyl-dimethyl-(2-methylpropyl)azanium
CID 19691395
N-methyl-N-(2-methylbutyl)formamide
CID 54200737
N-methyl-N-(3-methylbutyl)formamide
CID 54215428
N-formyl-N,2-dimethylpropanamide
CID 54304903
N-formyl-N-propylformamide
CID 54404212
N-(2,2-dimethylpropyl)-N-methylformamide
CID 54522026
N-(methoxymethyl)-N-propylformamide
CID 88769877

Frequently Asked Questions

What is the IUPAC name of N-formyl-N-(2-methylpropyl)formamide?
The IUPAC name of N-formyl-N-(2-methylpropyl)formamide (CID 18769156) is N-formyl-N-(2-methylpropyl)formamide.
What is the SMILES notation for N-formyl-N-(2-methylpropyl)formamide?
The canonical SMILES for N-formyl-N-(2-methylpropyl)formamide is CC(C)CN(C=O)C=O.
What is the InChIKey of N-formyl-N-(2-methylpropyl)formamide?
The InChIKey is BIOFIDKMCMUGKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-6(2)3-7(4-8)5-9/h4-6H,3H2,1-2H3.
What are the key properties of N-formyl-N-(2-methylpropyl)formamide?
N-formyl-N-(2-methylpropyl)formamide has a molecular weight of 129.16 g/mol, XLogP of 0.26, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-formyl-N-(2-methylpropyl)formamide is sourced from PubChem (CID 18769156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).