N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide

C11H18N2O2 — CID 79272522

IUPACN-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide
SMILESC#CCNCC(=O)NC1CCCCC1O
InChIInChI=1S/C11H18N2O2/c1-2-7-12-8-11(15)13-9-5-3-4-6-10(9)14/h1,9-10,12,14H,3-8H2,(H,13,15)
InChIKeyUZZAQKQMHCWLLK-UHFFFAOYSA-N
MW210.28 g/mol
LogP-0.37
Rot. Bonds4

About N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide

N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide (PubChem CID 79272522) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide.

Molecular Properties

Compound NameN-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide
PubChem CID79272522
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide
SMILESC#CCNCC(=O)NC1CCCCC1O
InChIInChI=1S/C11H18N2O2/c1-2-7-12-8-11(15)13-9-5-3-4-6-10(9)14/h1,9-10,12,14H,3-8H2,(H,13,15)
InChIKeyUZZAQKQMHCWLLK-UHFFFAOYSA-N
XLogP-0.37
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

N-[2-(hydroxymethyl)cyclopentyl]-2-(prop-2-ynylamino)acetamide
CID 106361263
2-acetamido-N-[(1S,2S)-2-hydroxycyclooctyl]acetamide
CID 146041857
N-(4-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide
CID 79286896
2-hydroxy-N-[(1R,2R)-2-hydroxycycloheptyl]acetamide
CID 130693023
2-bromo-N-(2-hydroxycyclohexyl)acetamide
CID 63680498
N-[(1R,2S)-2-hydroxycyclohexyl]-N'-[(1S,2R)-2-hydroxycyclohexyl]hexanediamide
CID 40600214
N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide
CID 62358678
2-(dimethylamino)-N-[(1S,2S)-2-hydroxycyclohexyl]acetamide
CID 104969353
2-cyano-N-(2-hydroxycyclohexyl)acetamide
CID 62358723
N-(2-hydroxycyclopentyl)-3-oxobutanamide
CID 127002121
N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide
CID 146041512
N-(2-hydroxycyclopentyl)butanamide
CID 72951810

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide?
The IUPAC name of N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide (CID 79272522) is N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide.
What is the SMILES notation for N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide?
The canonical SMILES for N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide is C#CCNCC(=O)NC1CCCCC1O.
What is the InChIKey of N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide?
The InChIKey is UZZAQKQMHCWLLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-2-7-12-8-11(15)13-9-5-3-4-6-10(9)14/h1,9-10,12,14H,3-8H2,(H,13,15).
What are the key properties of N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide?
N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide has a molecular weight of 210.28 g/mol, XLogP of -0.37, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclohexyl)-2-(prop-2-ynylamino)acetamide is sourced from PubChem (CID 79272522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).