2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide

C11H21N3O3 — CID 102631962

IUPAC2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide
SMILESCN(C(=O)CNC(=O)CN)C1CCCCC1O
InChIInChI=1S/C11H21N3O3/c1-14(8-4-2-3-5-9(8)15)11(17)7-13-10(16)6-12/h8-9,15H,2-7,12H2,1H3,(H,13,16)
InChIKeyLHCJPZBOWACEFZ-UHFFFAOYSA-N
MW243.31 g/mol
LogP-1.18
Rot. Bonds4

About 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide

2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide (PubChem CID 102631962) has the molecular formula C11H21N3O3 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide
PubChem CID102631962
Molecular FormulaC11H21N3O3
Molecular Weight243.31 g/mol
Exact Mass243.16
IUPAC Name2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide
SMILESCN(C(=O)CNC(=O)CN)C1CCCCC1O
InChIInChI=1S/C11H21N3O3/c1-14(8-4-2-3-5-9(8)15)11(17)7-13-10(16)6-12/h8-9,15H,2-7,12H2,1H3,(H,13,16)
InChIKeyLHCJPZBOWACEFZ-UHFFFAOYSA-N
XLogP-1.18
TPSA95.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 5-1.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide?
The IUPAC name of 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide (CID 102631962) is 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide is CN(C(=O)CNC(=O)CN)C1CCCCC1O.
What is the InChIKey of 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide?
The InChIKey is LHCJPZBOWACEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3/c1-14(8-4-2-3-5-9(8)15)11(17)7-13-10(16)6-12/h8-9,15H,2-7,12H2,1H3,(H,13,16).
What are the key properties of 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide?
2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide has a molecular weight of 243.31 g/mol, XLogP of -1.18, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide is sourced from PubChem (CID 102631962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).