N-methyl-N-[3-(methylamino)propyl]formamide

C6H14N2O — CID 541694

IUPACN-methyl-N-[3-(methylamino)propyl]formamide
SMILESCNCCCN(C)C=O
InChIInChI=1S/C6H14N2O/c1-7-4-3-5-8(2)6-9/h6-7H,3-5H2,1-2H3
InChIKeyUIYZUGSVJIZNDH-UHFFFAOYSA-N
MW130.19 g/mol
LogP-0.32
Rot. Bonds5

About N-methyl-N-[3-(methylamino)propyl]formamide

N-methyl-N-[3-(methylamino)propyl]formamide (PubChem CID 541694) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is N-methyl-N-[3-(methylamino)propyl]formamide.

Molecular Properties

Compound NameN-methyl-N-[3-(methylamino)propyl]formamide
PubChem CID541694
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC NameN-methyl-N-[3-(methylamino)propyl]formamide
SMILESCNCCCN(C)C=O
InChIInChI=1S/C6H14N2O/c1-7-4-3-5-8(2)6-9/h6-7H,3-5H2,1-2H3
InChIKeyUIYZUGSVJIZNDH-UHFFFAOYSA-N
XLogP-0.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[3-(methylamino)propyl]formamide?
The IUPAC name of N-methyl-N-[3-(methylamino)propyl]formamide (CID 541694) is N-methyl-N-[3-(methylamino)propyl]formamide.
What is the SMILES notation for N-methyl-N-[3-(methylamino)propyl]formamide?
The canonical SMILES for N-methyl-N-[3-(methylamino)propyl]formamide is CNCCCN(C)C=O.
What is the InChIKey of N-methyl-N-[3-(methylamino)propyl]formamide?
The InChIKey is UIYZUGSVJIZNDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-7-4-3-5-8(2)6-9/h6-7H,3-5H2,1-2H3.
What are the key properties of N-methyl-N-[3-(methylamino)propyl]formamide?
N-methyl-N-[3-(methylamino)propyl]formamide has a molecular weight of 130.19 g/mol, XLogP of -0.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[3-(methylamino)propyl]formamide is sourced from PubChem (CID 541694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).