CID 59445332

C7H15N2O — CID 59445332

IUPAC—
SMILESCNC(=O)CCCCC[NH]
InChIInChI=1S/C7H15N2O/c1-9-7(10)5-3-2-4-6-8/h8H,2-6H2,1H3,(H,9,10)
InChIKeyJGQSXHAQTLHFJJ-UHFFFAOYSA-N
MW143.21 g/mol
LogP0.58
Rot. Bonds5

About CID 59445332

CID 59445332 (PubChem CID 59445332) has the molecular formula C7H15N2O and a molecular weight of 143.21 g/mol.

Molecular Properties

Compound NameCID 59445332
PubChem CID59445332
Molecular FormulaC7H15N2O
Molecular Weight143.21 g/mol
Exact Mass143.12
IUPAC Name—
SMILESCNC(=O)CCCCC[NH]
InChIInChI=1S/C7H15N2O/c1-9-7(10)5-3-2-4-6-8/h8H,2-6H2,1H3,(H,9,10)
InChIKeyJGQSXHAQTLHFJJ-UHFFFAOYSA-N
XLogP0.58
TPSA52.90 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N'-dimethylheptanediamide
CID 15166696
N-methylheptacosanamide
CID 18175889
N-methylnonadecanamide
CID 2724821
N-methylundecanamide
CID 23297450
N-methyl-11-(methylamino)undecanamide
CID 59809097
N-methyl-N'-sulfanylnonanediamide
CID 143363504
N-methyl-6-sulfanylhexanamide
CID 58262294
ethane;N-methyltetradecanamide
CID 153349961
N,7-dimethyloctanamide;molecular hydrogen
CID 164603110
N-methyl-18-oxooctadecanamide
CID 145081820
6-(methylamino)-6-oxohexanoic acid;pentanedioic acid
CID 175448112
5-bromo-N-methylpentanamide
CID 19971018

Frequently Asked Questions

What is the IUPAC name of CID 59445332?
The IUPAC name of CID 59445332 (CID 59445332) is not available.
What is the SMILES notation for CID 59445332?
The canonical SMILES for CID 59445332 is CNC(=O)CCCCC[NH].
What is the InChIKey of CID 59445332?
The InChIKey is JGQSXHAQTLHFJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N2O/c1-9-7(10)5-3-2-4-6-8/h8H,2-6H2,1H3,(H,9,10).
What are the key properties of CID 59445332?
CID 59445332 has a molecular weight of 143.21 g/mol, XLogP of 0.58, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59445332 is sourced from PubChem (CID 59445332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).