N-methyl-N-propylformamide

C5H11NO — CID 19070644

IUPACN-methyl-N-propylformamide
SMILESCCCN(C)C=O
InChIInChI=1S/C5H11NO/c1-3-4-6(2)5-7/h5H,3-4H2,1-2H3
InChIKeySOZXLLYDRJGVCI-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.48
Rot. Bonds3

About N-methyl-N-propylformamide

N-methyl-N-propylformamide (PubChem CID 19070644) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is N-methyl-N-propylformamide.

Molecular Properties

Compound NameN-methyl-N-propylformamide
PubChem CID19070644
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC NameN-methyl-N-propylformamide
SMILESCCCN(C)C=O
InChIInChI=1S/C5H11NO/c1-3-4-6(2)5-7/h5H,3-4H2,1-2H3
InChIKeySOZXLLYDRJGVCI-UHFFFAOYSA-N
XLogP0.48
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Diethylformamide
CID 12051
N,N-Dibutylformamide
CID 12975
N,N-Dipropylformamide
CID 22687
N,N-bis(1-methylethyl)formamide
CID 75912
N-ethyl-N-methylformamide
CID 350667
Methylbutylformamide
CID 14230
N-methyl-N-(propan-2-yl)formamide
CID 14529853
N-butyl-N-formylformamide
CID 15721136
N-(hydroxymethyl)-N-propylformamide
CID 13163679
N-isopropyl-N-n-propylformamide
CID 19070657
N-ethyl-N-propan-2-ylformamide
CID 19828862
N-ethyl-N-(methoxymethyl)formamide
CID 134890489

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propylformamide?
The IUPAC name of N-methyl-N-propylformamide (CID 19070644) is N-methyl-N-propylformamide.
What is the SMILES notation for N-methyl-N-propylformamide?
The canonical SMILES for N-methyl-N-propylformamide is CCCN(C)C=O.
What is the InChIKey of N-methyl-N-propylformamide?
The InChIKey is SOZXLLYDRJGVCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-3-4-6(2)5-7/h5H,3-4H2,1-2H3.
What are the key properties of N-methyl-N-propylformamide?
N-methyl-N-propylformamide has a molecular weight of 101.15 g/mol, XLogP of 0.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propylformamide is sourced from PubChem (CID 19070644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).