N-hydroxyadamantane-1-carboxamide

C11H17NO2 — CID 703015

IUPACN-hydroxyadamantane-1-carboxamide
SMILESO=C(NO)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C11H17NO2/c13-10(12-14)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9,14H,1-6H2,(H,12,13)
InChIKeyAQEGTMVLCRSXRH-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.71
Rot. Bonds1

About N-hydroxyadamantane-1-carboxamide

N-hydroxyadamantane-1-carboxamide (PubChem CID 703015) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is N-hydroxyadamantane-1-carboxamide.

Molecular Properties

Compound NameN-hydroxyadamantane-1-carboxamide
PubChem CID703015
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC NameN-hydroxyadamantane-1-carboxamide
SMILESO=C(NO)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C11H17NO2/c13-10(12-14)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9,14H,1-6H2,(H,12,13)
InChIKeyAQEGTMVLCRSXRH-UHFFFAOYSA-N
XLogP1.71
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxyadamantane-1-carboxamide?
The IUPAC name of N-hydroxyadamantane-1-carboxamide (CID 703015) is N-hydroxyadamantane-1-carboxamide.
What is the SMILES notation for N-hydroxyadamantane-1-carboxamide?
The canonical SMILES for N-hydroxyadamantane-1-carboxamide is O=C(NO)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-hydroxyadamantane-1-carboxamide?
The InChIKey is AQEGTMVLCRSXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c13-10(12-14)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9,14H,1-6H2,(H,12,13).
What are the key properties of N-hydroxyadamantane-1-carboxamide?
N-hydroxyadamantane-1-carboxamide has a molecular weight of 195.26 g/mol, XLogP of 1.71, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxyadamantane-1-carboxamide is sourced from PubChem (CID 703015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).