2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide

C13H24N2O2 — CID 62825268

IUPAC2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide
SMILESNC1CCCC(CC(=O)NCC2CCOC2)C1
InChIInChI=1S/C13H24N2O2/c14-12-3-1-2-10(6-12)7-13(16)15-8-11-4-5-17-9-11/h10-12H,1-9,14H2,(H,15,16)
InChIKeyXACNVJASYPBNPI-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.05
Rot. Bonds4

About 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide

2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide (PubChem CID 62825268) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide
PubChem CID62825268
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide
SMILESNC1CCCC(CC(=O)NCC2CCOC2)C1
InChIInChI=1S/C13H24N2O2/c14-12-3-1-2-10(6-12)7-13(16)15-8-11-4-5-17-9-11/h10-12H,1-9,14H2,(H,15,16)
InChIKeyXACNVJASYPBNPI-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-aminocyclohexyl)methyl]-2-cyclohexylacetamide
CID 106123088
2-(3-aminocyclohexyl)-N-(oxolan-3-yl)acetamide
CID 80715851
2-(3-aminocyclohexyl)-N-(oxan-2-ylmethyl)acetamide
CID 55116671
N-[(3-aminocyclohexyl)methyl]oxane-4-carboxamide
CID 106123693
N-[(3-aminocyclopentyl)methyl]-2-cyclopropylacetamide
CID 83619287
2-hydroxy-N-(oxan-3-ylmethyl)acetamide
CID 130804735
2-(3-aminocyclohexyl)-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 62783174
2-(3-aminocyclohexyl)-N-(2,2-dimethylpropyl)acetamide
CID 62782744
2-(cyclopentylamino)-N-(oxolan-3-ylmethyl)acetamide
CID 60920124
2-(3-aminocyclohexyl)-N-pentylacetamide
CID 62783155
2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide
CID 62825271
N-(oxan-3-ylmethyl)-2-pyrrolidin-2-ylacetamide
CID 61366642

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide?
The IUPAC name of 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide (CID 62825268) is 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide?
The canonical SMILES for 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide is NC1CCCC(CC(=O)NCC2CCOC2)C1.
What is the InChIKey of 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide?
The InChIKey is XACNVJASYPBNPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c14-12-3-1-2-10(6-12)7-13(16)15-8-11-4-5-17-9-11/h10-12H,1-9,14H2,(H,15,16).
What are the key properties of 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide?
2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide has a molecular weight of 240.35 g/mol, XLogP of 1.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminocyclohexyl)-N-(oxolan-3-ylmethyl)acetamide is sourced from PubChem (CID 62825268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).