N-cyclopropyl-N-(1-hydroxyethyl)formamide

C6H11NO2 — CID 174552512

IUPACN-cyclopropyl-N-(1-hydroxyethyl)formamide
SMILESCC(O)N(C=O)C1CC1
InChIInChI=1S/C6H11NO2/c1-5(9)7(4-8)6-2-3-6/h4-6,9H,2-3H2,1H3
InChIKeyAGMIXKRWHAPNAN-UHFFFAOYSA-N
MW129.16 g/mol
LogP-0.05
Rot. Bonds3

About N-cyclopropyl-N-(1-hydroxyethyl)formamide

N-cyclopropyl-N-(1-hydroxyethyl)formamide (PubChem CID 174552512) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is N-cyclopropyl-N-(1-hydroxyethyl)formamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(1-hydroxyethyl)formamide
PubChem CID174552512
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC NameN-cyclopropyl-N-(1-hydroxyethyl)formamide
SMILESCC(O)N(C=O)C1CC1
InChIInChI=1S/C6H11NO2/c1-5(9)7(4-8)6-2-3-6/h4-6,9H,2-3H2,1H3
InChIKeyAGMIXKRWHAPNAN-UHFFFAOYSA-N
XLogP-0.05
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
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-cyclopropyl-N-(1-hydroxyethyl)formamide?
The IUPAC name of N-cyclopropyl-N-(1-hydroxyethyl)formamide (CID 174552512) is N-cyclopropyl-N-(1-hydroxyethyl)formamide.
What is the SMILES notation for N-cyclopropyl-N-(1-hydroxyethyl)formamide?
The canonical SMILES for N-cyclopropyl-N-(1-hydroxyethyl)formamide is CC(O)N(C=O)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(1-hydroxyethyl)formamide?
The InChIKey is AGMIXKRWHAPNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-5(9)7(4-8)6-2-3-6/h4-6,9H,2-3H2,1H3.
What are the key properties of N-cyclopropyl-N-(1-hydroxyethyl)formamide?
N-cyclopropyl-N-(1-hydroxyethyl)formamide has a molecular weight of 129.16 g/mol, XLogP of -0.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(1-hydroxyethyl)formamide is sourced from PubChem (CID 174552512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).