N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide

C16H29NO2 — CID 103860474

IUPACN-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide
SMILESO=C(NC1CCCCC1CO)C1CCCCCCC1
InChIInChI=1S/C16H29NO2/c18-12-14-10-6-7-11-15(14)17-16(19)13-8-4-2-1-3-5-9-13/h13-15,18H,1-12H2,(H,17,19)
InChIKeyPVZCHNJHJTZUCX-UHFFFAOYSA-N
MW267.41 g/mol
LogP3.01
Rot. Bonds3

About N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide

N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide (PubChem CID 103860474) has the molecular formula C16H29NO2 and a molecular weight of 267.41 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide
PubChem CID103860474
Molecular FormulaC16H29NO2
Molecular Weight267.41 g/mol
Exact Mass267.22
IUPAC NameN-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide
SMILESO=C(NC1CCCCC1CO)C1CCCCCCC1
InChIInChI=1S/C16H29NO2/c18-12-14-10-6-7-11-15(14)17-16(19)13-8-4-2-1-3-5-9-13/h13-15,18H,1-12H2,(H,17,19)
InChIKeyPVZCHNJHJTZUCX-UHFFFAOYSA-N
XLogP3.01
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.41
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(chloromethyl)cyclopentyl]cycloheptanecarboxamide
CID 106366097
N-[2-(cyclooctanecarbonylamino)cyclohexyl]cyclooctanecarboxamide
CID 171722262
N-[2-(chloromethyl)cyclohexyl]cyclobutanecarboxamide
CID 106366933
3-[[2-(hydroxymethyl)cyclopentyl]carbamoyl]cyclopentane-1-carboxylic acid
CID 114178456
[(1R,2R)-2-(hydroxymethyl)cyclohexyl]carbamic acid
CID 141194189
N-[2-(hydroxymethyl)cyclohexyl]prop-2-ynamide
CID 103860466
2-amino-N-[2-(hydroxymethyl)cyclopentyl]cyclohexane-1-carboxamide
CID 103811440
N-[(1R,2R)-2-(hydroxymethyl)cyclohexyl]adamantane-2-carboxamide
CID 97080184
(2R)-N-[2-(hydroxymethyl)cyclohexyl]piperidine-2-carboxamide
CID 114178725
N-(2-aminocyclopropyl)cyclohexanecarboxamide
CID 43593715
[(1R,2S)-2-(hydroxymethyl)cyclopentyl]urea
CID 131092066
2-cyclohexyl-N-[2-(hydroxymethyl)cyclopentyl]acetamide
CID 103751275

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide (CID 103860474) is N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide is O=C(NC1CCCCC1CO)C1CCCCCCC1.
What is the InChIKey of N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide?
The InChIKey is PVZCHNJHJTZUCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO2/c18-12-14-10-6-7-11-15(14)17-16(19)13-8-4-2-1-3-5-9-13/h13-15,18H,1-12H2,(H,17,19).
What are the key properties of N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide?
N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide has a molecular weight of 267.41 g/mol, XLogP of 3.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide is sourced from PubChem (CID 103860474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).