[3-(2-iminopropyl)cyclohexyl]methanol

C10H19NO — CID 90969056

IUPAC[3-(2-iminopropyl)cyclohexyl]methanol
SMILES[H]/N=C(\C)CC1CCCC(CO)C1
InChIInChI=1S/C10H19NO/c1-8(11)5-9-3-2-4-10(6-9)7-12/h9-12H,2-7H2,1H3/b11-8+
InChIKeyOQGILDZJAYDAHI-DHZHZOJOSA-N
MW169.27 g/mol
LogP2.21
Rot. Bonds3

About [3-(2-iminopropyl)cyclohexyl]methanol

[3-(2-iminopropyl)cyclohexyl]methanol (PubChem CID 90969056) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is [3-(2-iminopropyl)cyclohexyl]methanol.

Molecular Properties

Compound Name[3-(2-iminopropyl)cyclohexyl]methanol
PubChem CID90969056
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name[3-(2-iminopropyl)cyclohexyl]methanol
SMILES[H]/N=C(\C)CC1CCCC(CO)C1
InChIInChI=1S/C10H19NO/c1-8(11)5-9-3-2-4-10(6-9)7-12/h9-12H,2-7H2,1H3/b11-8+
InChIKeyOQGILDZJAYDAHI-DHZHZOJOSA-N
XLogP2.21
TPSA44.08 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 [3-(2-iminopropyl)cyclohexyl]methanol?
The IUPAC name of [3-(2-iminopropyl)cyclohexyl]methanol (CID 90969056) is [3-(2-iminopropyl)cyclohexyl]methanol.
What is the SMILES notation for [3-(2-iminopropyl)cyclohexyl]methanol?
The canonical SMILES for [3-(2-iminopropyl)cyclohexyl]methanol is [H]/N=C(\C)CC1CCCC(CO)C1.
What is the InChIKey of [3-(2-iminopropyl)cyclohexyl]methanol?
The InChIKey is OQGILDZJAYDAHI-DHZHZOJOSA-N. The full InChI is InChI=1S/C10H19NO/c1-8(11)5-9-3-2-4-10(6-9)7-12/h9-12H,2-7H2,1H3/b11-8+.
What are the key properties of [3-(2-iminopropyl)cyclohexyl]methanol?
[3-(2-iminopropyl)cyclohexyl]methanol has a molecular weight of 169.27 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-iminopropyl)cyclohexyl]methanol is sourced from PubChem (CID 90969056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).