N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide

C12H21NO2 — CID 146041512

IUPACN-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide
SMILESO=C(N[C@H]1CCCCCC[C@@H]1O)C1CC1
InChIInChI=1S/C12H21NO2/c14-11-6-4-2-1-3-5-10(11)13-12(15)9-7-8-9/h9-11,14H,1-8H2,(H,13,15)/t10-,11-/m0/s1
InChIKeyZCZOSNGNEASKNJ-QWRGUYRKSA-N
MW211.30 g/mol
LogP1.60
Rot. Bonds2

About N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide

N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide (PubChem CID 146041512) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide
PubChem CID146041512
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC NameN-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide
SMILESO=C(N[C@H]1CCCCCC[C@@H]1O)C1CC1
InChIInChI=1S/C12H21NO2/c14-11-6-4-2-1-3-5-10(11)13-12(15)9-7-8-9/h9-11,14H,1-8H2,(H,13,15)/t10-,11-/m0/s1
InChIKeyZCZOSNGNEASKNJ-QWRGUYRKSA-N
XLogP1.60
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R,2R)-2-hydroxycyclohexyl]cyclopent-3-ene-1-carboxamide
CID 104927999
N-[2-(cyclooctanecarbonylamino)cyclohexyl]cyclooctanecarboxamide
CID 171722262
3-amino-N-(2-hydroxycyclohexyl)cyclopentane-1-carboxamide
CID 66007557
3,3-difluoro-N-[(1S,2S)-2-hydroxycyclohexyl]cyclohexane-1-carboxamide
CID 114226447
N-[(1R,2R)-2-hydroxycyclohexyl]piperidine-3-carboxamide
CID 107222065
4-sulfanyl-N-[2-[(4-sulfanylcyclohexanecarbonyl)amino]cyclohexyl]cyclohexane-1-carboxamide
CID 171722592
N-[(1S,2S)-2-hydroxycycloheptyl]acetamide
CID 101001127
4-N-[(1R,2R)-2-hydroxycyclohexyl]-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 104927639
2-amino-N-[(1S,2S)-2-hydroxycyclohexyl]cycloheptane-1-carboxamide
CID 107221615
2-hydroxy-N-[(1R,2R)-2-hydroxycycloheptyl]acetamide
CID 130693023
N-[(1R,2R)-2-hydroxycyclohexyl]-5-methyloxolane-3-carboxamide
CID 102677288
5-[(2-hydroxycyclohexyl)carbamoyl]oxolane-2-carboxylic acid
CID 102688444

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide?
The IUPAC name of N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide (CID 146041512) is N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide is O=C(N[C@H]1CCCCCC[C@@H]1O)C1CC1.
What is the InChIKey of N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide?
The InChIKey is ZCZOSNGNEASKNJ-QWRGUYRKSA-N. The full InChI is InChI=1S/C12H21NO2/c14-11-6-4-2-1-3-5-10(11)13-12(15)9-7-8-9/h9-11,14H,1-8H2,(H,13,15)/t10-,11-/m0/s1.
What are the key properties of N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide?
N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide has a molecular weight of 211.30 g/mol, XLogP of 1.60, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2S)-2-hydroxycyclooctyl]cyclopropanecarboxamide is sourced from PubChem (CID 146041512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).