N-methyl-N-[(Z)-pentylideneamino]formamide

C7H14N2O — CID 5367941

IUPACN-methyl-N-[(Z)-pentylideneamino]formamide
SMILESCCCC/C=N\N(C)C=O
InChIInChI=1S/C7H14N2O/c1-3-4-5-6-8-9(2)7-10/h6-7H,3-5H2,1-2H3/b8-6-
InChIKeyIHTUGUQGWPOOJG-VURMDHGXSA-N
MW142.20 g/mol
LogP1.25
Rot. Bonds5

About N-methyl-N-[(Z)-pentylideneamino]formamide

N-methyl-N-[(Z)-pentylideneamino]formamide (PubChem CID 5367941) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N-methyl-N-[(Z)-pentylideneamino]formamide.

Molecular Properties

Compound NameN-methyl-N-[(Z)-pentylideneamino]formamide
PubChem CID5367941
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN-methyl-N-[(Z)-pentylideneamino]formamide
SMILESCCCC/C=N\N(C)C=O
InChIInChI=1S/C7H14N2O/c1-3-4-5-6-8-9(2)7-10/h6-7H,3-5H2,1-2H3/b8-6-
InChIKeyIHTUGUQGWPOOJG-VURMDHGXSA-N
XLogP1.25
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(Z)-pentylideneamino]formamide?
The IUPAC name of N-methyl-N-[(Z)-pentylideneamino]formamide (CID 5367941) is N-methyl-N-[(Z)-pentylideneamino]formamide.
What is the SMILES notation for N-methyl-N-[(Z)-pentylideneamino]formamide?
The canonical SMILES for N-methyl-N-[(Z)-pentylideneamino]formamide is CCCC/C=N\N(C)C=O.
What is the InChIKey of N-methyl-N-[(Z)-pentylideneamino]formamide?
The InChIKey is IHTUGUQGWPOOJG-VURMDHGXSA-N. The full InChI is InChI=1S/C7H14N2O/c1-3-4-5-6-8-9(2)7-10/h6-7H,3-5H2,1-2H3/b8-6-.
What are the key properties of N-methyl-N-[(Z)-pentylideneamino]formamide?
N-methyl-N-[(Z)-pentylideneamino]formamide has a molecular weight of 142.20 g/mol, XLogP of 1.25, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(Z)-pentylideneamino]formamide is sourced from PubChem (CID 5367941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).