2-cyclohexyl-2-(ethylideneamino)acetic acid

C10H17NO2 — CID 143195148

IUPAC2-cyclohexyl-2-(ethylideneamino)acetic acid
SMILESC/C=N/C(C(=O)O)C1CCCCC1
InChIInChI=1S/C10H17NO2/c1-2-11-9(10(12)13)8-6-4-3-5-7-8/h2,8-9H,3-7H2,1H3,(H,12,13)/b11-2+
InChIKeyBSORLFGUGNPTLX-BIIKFXOESA-N
MW183.25 g/mol
LogP2.11
Rot. Bonds3

About 2-cyclohexyl-2-(ethylideneamino)acetic acid

2-cyclohexyl-2-(ethylideneamino)acetic acid (PubChem CID 143195148) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-cyclohexyl-2-(ethylideneamino)acetic acid.

Molecular Properties

Compound Name2-cyclohexyl-2-(ethylideneamino)acetic acid
PubChem CID143195148
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name2-cyclohexyl-2-(ethylideneamino)acetic acid
SMILESC/C=N/C(C(=O)O)C1CCCCC1
InChIInChI=1S/C10H17NO2/c1-2-11-9(10(12)13)8-6-4-3-5-7-8/h2,8-9H,3-7H2,1H3,(H,12,13)/b11-2+
InChIKeyBSORLFGUGNPTLX-BIIKFXOESA-N
XLogP2.11
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 52.11
H-Bond Donors ≤ 51
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 2-cyclohexyl-2-(ethylideneamino)acetic acid?
The IUPAC name of 2-cyclohexyl-2-(ethylideneamino)acetic acid (CID 143195148) is 2-cyclohexyl-2-(ethylideneamino)acetic acid.
What is the SMILES notation for 2-cyclohexyl-2-(ethylideneamino)acetic acid?
The canonical SMILES for 2-cyclohexyl-2-(ethylideneamino)acetic acid is C/C=N/C(C(=O)O)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2-(ethylideneamino)acetic acid?
The InChIKey is BSORLFGUGNPTLX-BIIKFXOESA-N. The full InChI is InChI=1S/C10H17NO2/c1-2-11-9(10(12)13)8-6-4-3-5-7-8/h2,8-9H,3-7H2,1H3,(H,12,13)/b11-2+.
What are the key properties of 2-cyclohexyl-2-(ethylideneamino)acetic acid?
2-cyclohexyl-2-(ethylideneamino)acetic acid has a molecular weight of 183.25 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-(ethylideneamino)acetic acid is sourced from PubChem (CID 143195148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).