(2-imino-4-methoxycyclopentyl)methanol

C7H13NO2 — CID 143834833

IUPAC(2-imino-4-methoxycyclopentyl)methanol
SMILES[H]/N=C1\CC(OC)CC1CO
InChIInChI=1S/C7H13NO2/c1-10-6-2-5(4-9)7(8)3-6/h5-6,8-9H,2-4H2,1H3/b8-7+
InChIKeyJUEODOWWMDADJE-BQYQJAHWSA-N
MW143.19 g/mol
LogP0.42
Rot. Bonds2

About (2-imino-4-methoxycyclopentyl)methanol

(2-imino-4-methoxycyclopentyl)methanol (PubChem CID 143834833) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is (2-imino-4-methoxycyclopentyl)methanol.

Molecular Properties

Compound Name(2-imino-4-methoxycyclopentyl)methanol
PubChem CID143834833
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name(2-imino-4-methoxycyclopentyl)methanol
SMILES[H]/N=C1\CC(OC)CC1CO
InChIInChI=1S/C7H13NO2/c1-10-6-2-5(4-9)7(8)3-6/h5-6,8-9H,2-4H2,1H3/b8-7+
InChIKeyJUEODOWWMDADJE-BQYQJAHWSA-N
XLogP0.42
TPSA53.31 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-imino-4-methoxycyclopentyl)methanol?
The IUPAC name of (2-imino-4-methoxycyclopentyl)methanol (CID 143834833) is (2-imino-4-methoxycyclopentyl)methanol.
What is the SMILES notation for (2-imino-4-methoxycyclopentyl)methanol?
The canonical SMILES for (2-imino-4-methoxycyclopentyl)methanol is [H]/N=C1\CC(OC)CC1CO.
What is the InChIKey of (2-imino-4-methoxycyclopentyl)methanol?
The InChIKey is JUEODOWWMDADJE-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H13NO2/c1-10-6-2-5(4-9)7(8)3-6/h5-6,8-9H,2-4H2,1H3/b8-7+.
What are the key properties of (2-imino-4-methoxycyclopentyl)methanol?
(2-imino-4-methoxycyclopentyl)methanol has a molecular weight of 143.19 g/mol, XLogP of 0.42, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-imino-4-methoxycyclopentyl)methanol is sourced from PubChem (CID 143834833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).