4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide

C12H22N2O3 — CID 66235488

IUPAC4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide
SMILESNC1COCC1C(=O)NCC1CCCCC1O
InChIInChI=1S/C12H22N2O3/c13-10-7-17-6-9(10)12(16)14-5-8-3-1-2-4-11(8)15/h8-11,15H,1-7,13H2,(H,14,16)
InChIKeyAKBRLRGPGPSNKP-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.37
Rot. Bonds3

About 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide

4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide (PubChem CID 66235488) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide
PubChem CID66235488
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide
SMILESNC1COCC1C(=O)NCC1CCCCC1O
InChIInChI=1S/C12H22N2O3/c13-10-7-17-6-9(10)12(16)14-5-8-3-1-2-4-11(8)15/h8-11,15H,1-7,13H2,(H,14,16)
InChIKeyAKBRLRGPGPSNKP-UHFFFAOYSA-N
XLogP-0.37
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-N-[(2-methylcyclohexyl)methyl]oxolane-3-carboxamide
CID 66237085
N-[(2-hydroxycyclohexyl)methyl]cyclopentanecarboxamide
CID 64928899
N-[(2-hydroxycyclohexyl)methyl]oxane-3-carboxamide
CID 64911747
N-[(2-hydroxycyclohexyl)methyl]-1,4-dioxane-2-carboxamide
CID 64911345
N-[(2-hydroxycyclohexyl)methyl]-4-methylpyrrolidine-3-carboxamide
CID 64912863
4-[(2-hydroxycyclohexyl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120673772
4-amino-N-cycloheptyloxolane-3-carboxamide
CID 66240800
N-[(2-hydroxycyclopentyl)methyl]bicyclo[4.1.0]heptane-7-carboxamide
CID 79208729
4-amino-N-(2,2-dimethylpropyl)oxolane-3-carboxamide
CID 66237269
N-[(2-aminocyclopentyl)methyl]-3-methyloxane-4-carboxamide
CID 114241768
4-amino-N-(3,3,3-trifluoropropyl)oxolane-3-carboxamide
CID 66237706
4-amino-N-[(4-fluorophenyl)methyl]oxolane-3-carboxamide
CID 66239603

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide (CID 66235488) is 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide is NC1COCC1C(=O)NCC1CCCCC1O.
What is the InChIKey of 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide?
The InChIKey is AKBRLRGPGPSNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c13-10-7-17-6-9(10)12(16)14-5-8-3-1-2-4-11(8)15/h8-11,15H,1-7,13H2,(H,14,16).
What are the key properties of 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide?
4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide has a molecular weight of 242.32 g/mol, XLogP of -0.37, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[(2-hydroxycyclohexyl)methyl]oxolane-3-carboxamide is sourced from PubChem (CID 66235488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).