2-amino-N-(4-hydroxycyclohexyl)propanamide

C9H18N2O2 — CID 24704947

IUPAC2-amino-N-(4-hydroxycyclohexyl)propanamide
SMILESCC(N)C(=O)NC1CCC(O)CC1
InChIInChI=1S/C9H18N2O2/c1-6(10)9(13)11-7-2-4-8(12)5-3-7/h6-8,12H,2-5,10H2,1H3,(H,11,13)
InChIKeyDYVNVIUXCAUYFY-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.25
Rot. Bonds2

About 2-amino-N-(4-hydroxycyclohexyl)propanamide

2-amino-N-(4-hydroxycyclohexyl)propanamide (PubChem CID 24704947) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-amino-N-(4-hydroxycyclohexyl)propanamide.

Molecular Properties

Compound Name2-amino-N-(4-hydroxycyclohexyl)propanamide
PubChem CID24704947
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name2-amino-N-(4-hydroxycyclohexyl)propanamide
SMILESCC(N)C(=O)NC1CCC(O)CC1
InChIInChI=1S/C9H18N2O2/c1-6(10)9(13)11-7-2-4-8(12)5-3-7/h6-8,12H,2-5,10H2,1H3,(H,11,13)
InChIKeyDYVNVIUXCAUYFY-UHFFFAOYSA-N
XLogP-0.25
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-hydroxycyclohexyl)propanamide?
The IUPAC name of 2-amino-N-(4-hydroxycyclohexyl)propanamide (CID 24704947) is 2-amino-N-(4-hydroxycyclohexyl)propanamide.
What is the SMILES notation for 2-amino-N-(4-hydroxycyclohexyl)propanamide?
The canonical SMILES for 2-amino-N-(4-hydroxycyclohexyl)propanamide is CC(N)C(=O)NC1CCC(O)CC1.
What is the InChIKey of 2-amino-N-(4-hydroxycyclohexyl)propanamide?
The InChIKey is DYVNVIUXCAUYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-6(10)9(13)11-7-2-4-8(12)5-3-7/h6-8,12H,2-5,10H2,1H3,(H,11,13).
What are the key properties of 2-amino-N-(4-hydroxycyclohexyl)propanamide?
2-amino-N-(4-hydroxycyclohexyl)propanamide has a molecular weight of 186.25 g/mol, XLogP of -0.25, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-hydroxycyclohexyl)propanamide is sourced from PubChem (CID 24704947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).