N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide

C6H11NO2 — CID 115455292

IUPACN-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide
SMILESO=CNCC1(CO)CC1
InChIInChI=1S/C6H11NO2/c8-4-6(1-2-6)3-7-5-9/h5,8H,1-4H2,(H,7,9)
InChIKeyADSJSMLRFLIINV-UHFFFAOYSA-N
MW129.16 g/mol
LogP-0.50
Rot. Bonds4

About N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide

N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide (PubChem CID 115455292) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide.

Molecular Properties

Compound NameN-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide
PubChem CID115455292
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC NameN-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide
SMILESO=CNCC1(CO)CC1
InChIInChI=1S/C6H11NO2/c8-4-6(1-2-6)3-7-5-9/h5,8H,1-4H2,(H,7,9)
InChIKeyADSJSMLRFLIINV-UHFFFAOYSA-N
XLogP-0.50
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[1-[(2-fluoroethylamino)methyl]cyclopropyl]methanol
CID 115454656
1-[[1-(hydroxymethyl)cyclopropyl]methyl]-3-methylurea
CID 79461046
[1-(butylaminomethyl)cyclopropyl]methanol
CID 115454363
[1-[(oxoboranylmethylamino)methyl]cyclobutyl]methanol
CID 20714152
[1-(hydroxymethyl)cyclopentyl]methylcarbamic acid
CID 66597374
[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol
CID 115454729
2,2-difluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide
CID 103513976
3-[[1-(hydroxymethyl)cyclopropyl]methylamino]-2,2-dimethylpropan-1-ol
CID 115454323
N-[[1-(hydroxymethyl)cyclopropyl]methyl]prop-2-ynamide
CID 115455293
2-[[1-(hydroxymethyl)cyclopropyl]methylamino]butanamide
CID 115454582
[1-[(hexylamino)methyl]cyclopropyl]methanol
CID 115454400
N-[[1-(hydroxymethyl)cyclopropyl]methyl]but-3-ene-1-sulfonamide
CID 75431338

Frequently Asked Questions

What is the IUPAC name of N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide?
The IUPAC name of N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide (CID 115455292) is N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide.
What is the SMILES notation for N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide?
The canonical SMILES for N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide is O=CNCC1(CO)CC1.
What is the InChIKey of N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide?
The InChIKey is ADSJSMLRFLIINV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c8-4-6(1-2-6)3-7-5-9/h5,8H,1-4H2,(H,7,9).
What are the key properties of N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide?
N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide has a molecular weight of 129.16 g/mol, XLogP of -0.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(hydroxymethyl)cyclopropyl]methyl]formamide is sourced from PubChem (CID 115455292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).