N-(1-formamidopropyl)formamide

C5H10N2O2 — CID 11073450

IUPACN-(1-formamidopropyl)formamide
SMILESCCC(NC=O)NC=O
InChIInChI=1S/C5H10N2O2/c1-2-5(6-3-8)7-4-9/h3-5H,2H2,1H3,(H,6,8)(H,7,9)
InChIKeyYZGJPIQBTAYEEL-UHFFFAOYSA-N
MW130.15 g/mol
LogP-0.79
Rot. Bonds5

About N-(1-formamidopropyl)formamide

N-(1-formamidopropyl)formamide (PubChem CID 11073450) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is N-(1-formamidopropyl)formamide.

Molecular Properties

Compound NameN-(1-formamidopropyl)formamide
PubChem CID11073450
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC NameN-(1-formamidopropyl)formamide
SMILESCCC(NC=O)NC=O
InChIInChI=1S/C5H10N2O2/c1-2-5(6-3-8)7-4-9/h3-5H,2H2,1H3,(H,6,8)(H,7,9)
InChIKeyYZGJPIQBTAYEEL-UHFFFAOYSA-N
XLogP-0.79
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1-formamidopropyl)formamide?
The IUPAC name of N-(1-formamidopropyl)formamide (CID 11073450) is N-(1-formamidopropyl)formamide.
What is the SMILES notation for N-(1-formamidopropyl)formamide?
The canonical SMILES for N-(1-formamidopropyl)formamide is CCC(NC=O)NC=O.
What is the InChIKey of N-(1-formamidopropyl)formamide?
The InChIKey is YZGJPIQBTAYEEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-2-5(6-3-8)7-4-9/h3-5H,2H2,1H3,(H,6,8)(H,7,9).
What are the key properties of N-(1-formamidopropyl)formamide?
N-(1-formamidopropyl)formamide has a molecular weight of 130.15 g/mol, XLogP of -0.79, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-formamidopropyl)formamide is sourced from PubChem (CID 11073450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).