2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide

C12H23NO2 — CID 103884693

IUPAC2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide
SMILESC[C@H](O)CNC(=O)CC1CCCCCC1
InChIInChI=1S/C12H23NO2/c1-10(14)9-13-12(15)8-11-6-4-2-3-5-7-11/h10-11,14H,2-9H2,1H3,(H,13,15)/t10-/m0/s1
InChIKeySPBXVXDOQHGLNW-JTQLQIEISA-N
MW213.32 g/mol
LogP1.84
Rot. Bonds4

About 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide

2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide (PubChem CID 103884693) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide.

Molecular Properties

Compound Name2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide
PubChem CID103884693
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide
SMILESC[C@H](O)CNC(=O)CC1CCCCCC1
InChIInChI=1S/C12H23NO2/c1-10(14)9-13-12(15)8-11-6-4-2-3-5-7-11/h10-11,14H,2-9H2,1H3,(H,13,15)/t10-/m0/s1
InChIKeySPBXVXDOQHGLNW-JTQLQIEISA-N
XLogP1.84
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-N-(2-hydroxypropyl)acetamide
CID 60654176
2-cyclopentyl-N-(4-hydroxy-2-methylpentyl)acetamide
CID 111447247
N-(2-amino-3-hydroxybutyl)-2-cyclohexylacetamide
CID 64542106
2-cyclohexyl-N-[2-(methylamino)propyl]acetamide
CID 103512587
N-(2-hydroxypropyl)-2-piperidin-3-ylacetamide
CID 62674871
2-cyclopentyl-N-(2-hydroxy-4-methylpentyl)acetamide
CID 103770830
2-cyclopentyl-N-[2-[(2-cyclopentylacetyl)amino]propyl]acetamide
CID 54786980
N-(2-amino-4-methylpentyl)-2-cyclohexylacetamide
CID 107158692
2-cyclopentyl-N-(2,3-dihydroxypropyl)acetamide
CID 66175167
N-(2-chlorobutyl)-2-cycloheptylacetamide
CID 114459139
2-cycloheptyl-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
CID 113252022
2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide
CID 66107291

Frequently Asked Questions

What is the IUPAC name of 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide?
The IUPAC name of 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide (CID 103884693) is 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide.
What is the SMILES notation for 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide?
The canonical SMILES for 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide is C[C@H](O)CNC(=O)CC1CCCCCC1.
What is the InChIKey of 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide?
The InChIKey is SPBXVXDOQHGLNW-JTQLQIEISA-N. The full InChI is InChI=1S/C12H23NO2/c1-10(14)9-13-12(15)8-11-6-4-2-3-5-7-11/h10-11,14H,2-9H2,1H3,(H,13,15)/t10-/m0/s1.
What are the key properties of 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide?
2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide has a molecular weight of 213.32 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide is sourced from PubChem (CID 103884693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).