N-(oxolan-2-ylmethyl)formamide

C6H11NO2 — CID 18171882

IUPACN-(oxolan-2-ylmethyl)formamide
SMILESO=CNCC1CCCO1
InChIInChI=1S/C6H11NO2/c8-5-7-4-6-2-1-3-9-6/h5-6H,1-4H2,(H,7,8)
InChIKeyDGPQPAMQIBTOIT-UHFFFAOYSA-N
MW129.16 g/mol
LogP-0.09
Rot. Bonds3

About N-(oxolan-2-ylmethyl)formamide

N-(oxolan-2-ylmethyl)formamide (PubChem CID 18171882) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)formamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)formamide
PubChem CID18171882
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC NameN-(oxolan-2-ylmethyl)formamide
SMILESO=CNCC1CCCO1
InChIInChI=1S/C6H11NO2/c8-5-7-4-6-2-1-3-9-6/h5-6H,1-4H2,(H,7,8)
InChIKeyDGPQPAMQIBTOIT-UHFFFAOYSA-N
XLogP-0.09
TPSA38.33 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 ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(Tetrahydrofurfuryl)-N-methylamine
CID 98090
Acetamide, N-tetrahydrofurfuryl-2,2,2-trifluoro-
CID 532126
(Tetrahydro-furan-2-ylmethyl)-urea
CID 3680258
methyl({[(2R)-oxolan-2-yl]methyl})amine
CID 41098313
methyl((((2S)-oxolan-2-yl)methyl))amine
CID 41098315
n-(Tetrahydrofuran-2-ylmethyl)acetamide
CID 263164
N-[[5-(trifluoromethyl)oxolan-2-yl]methyl]formamide
CID 170084777
methyl N-(oxolan-2-ylmethyl)carbamate
CID 4185220
N-(oxolan-2-ylmethyl)prop-2-ynamide
CID 130015057
2,2-difluoro-N-(oxolan-2-ylmethyl)acetamide
CID 103600497
N-(oxolan-2-ylmethyl)propanamide
CID 4131915
ethyl N-(oxolan-2-ylmethyl)carbamate
CID 5104931

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)formamide?
The IUPAC name of N-(oxolan-2-ylmethyl)formamide (CID 18171882) is N-(oxolan-2-ylmethyl)formamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)formamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)formamide is O=CNCC1CCCO1.
What is the InChIKey of N-(oxolan-2-ylmethyl)formamide?
The InChIKey is DGPQPAMQIBTOIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c8-5-7-4-6-2-1-3-9-6/h5-6H,1-4H2,(H,7,8).
What are the key properties of N-(oxolan-2-ylmethyl)formamide?
N-(oxolan-2-ylmethyl)formamide has a molecular weight of 129.16 g/mol, XLogP of -0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)formamide is sourced from PubChem (CID 18171882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).