2-[(1-hydroxycyclohexyl)methylamino]acetamide

C9H18N2O2 — CID 60899404

IUPAC2-[(1-hydroxycyclohexyl)methylamino]acetamide
SMILESNC(=O)CNCC1(O)CCCCC1
InChIInChI=1S/C9H18N2O2/c10-8(12)6-11-7-9(13)4-2-1-3-5-9/h11,13H,1-7H2,(H2,10,12)
InChIKeyQRFVOVAJMFUMKS-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.24
Rot. Bonds4

About 2-[(1-hydroxycyclohexyl)methylamino]acetamide

2-[(1-hydroxycyclohexyl)methylamino]acetamide (PubChem CID 60899404) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-[(1-hydroxycyclohexyl)methylamino]acetamide.

Molecular Properties

Compound Name2-[(1-hydroxycyclohexyl)methylamino]acetamide
PubChem CID60899404
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name2-[(1-hydroxycyclohexyl)methylamino]acetamide
SMILESNC(=O)CNCC1(O)CCCCC1
InChIInChI=1S/C9H18N2O2/c10-8(12)6-11-7-9(13)4-2-1-3-5-9/h11,13H,1-7H2,(H2,10,12)
InChIKeyQRFVOVAJMFUMKS-UHFFFAOYSA-N
XLogP-0.24
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydroxycyclohexyl)methylamino]acetamide?
The IUPAC name of 2-[(1-hydroxycyclohexyl)methylamino]acetamide (CID 60899404) is 2-[(1-hydroxycyclohexyl)methylamino]acetamide.
What is the SMILES notation for 2-[(1-hydroxycyclohexyl)methylamino]acetamide?
The canonical SMILES for 2-[(1-hydroxycyclohexyl)methylamino]acetamide is NC(=O)CNCC1(O)CCCCC1.
What is the InChIKey of 2-[(1-hydroxycyclohexyl)methylamino]acetamide?
The InChIKey is QRFVOVAJMFUMKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c10-8(12)6-11-7-9(13)4-2-1-3-5-9/h11,13H,1-7H2,(H2,10,12).
What are the key properties of 2-[(1-hydroxycyclohexyl)methylamino]acetamide?
2-[(1-hydroxycyclohexyl)methylamino]acetamide has a molecular weight of 186.25 g/mol, XLogP of -0.24, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydroxycyclohexyl)methylamino]acetamide is sourced from PubChem (CID 60899404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).