N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide

C17H27NO2 — CID 103751548

IUPACN-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide
SMILESO=C(NC1CCCC1CO)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C17H27NO2/c19-9-12-2-1-3-15(12)18-17(20)16-13-5-10-4-11(7-13)8-14(16)6-10/h10-16,19H,1-9H2,(H,18,20)
InChIKeySKGQFJIUZFKFCH-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.34
Rot. Bonds3

About N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide

N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide (PubChem CID 103751548) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide
PubChem CID103751548
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC NameN-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide
SMILESO=C(NC1CCCC1CO)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C17H27NO2/c19-9-12-2-1-3-15(12)18-17(20)16-13-5-10-4-11(7-13)8-14(16)6-10/h10-16,19H,1-9H2,(H,18,20)
InChIKeySKGQFJIUZFKFCH-UHFFFAOYSA-N
XLogP2.34
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R,2R)-2-(hydroxymethyl)cyclohexyl]adamantane-2-carboxamide
CID 97080184
N-(2-chlorocyclopentyl)adamantane-2-carboxamide
CID 106443807
N-(2-bromocyclopentyl)adamantane-2-carboxamide
CID 81095777
2-[[2-(hydroxymethyl)cyclopentyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 106359251
3-[[2-(hydroxymethyl)cyclopentyl]carbamoyl]cyclopentane-1-carboxylic acid
CID 114178456
[(1R,2S)-2-(hydroxymethyl)cyclopentyl]urea
CID 131092066
N-[2-(hydroxymethyl)cyclohexyl]cyclooctanecarboxamide
CID 103860474
(2R)-N-[2-(hydroxymethyl)cyclopentyl]azetidine-2-carboxamide;hydrochloride
CID 130748048
2-amino-N-[2-(hydroxymethyl)cyclopentyl]cyclohexane-1-carboxamide
CID 103811440
(2R)-N-[2-(hydroxymethyl)cyclopentyl]pyrrolidine-2-carboxamide
CID 103796942
(2S)-N-[2-(hydroxymethyl)cyclopentyl]pyrrolidine-2-carboxamide
CID 103796945
[(1R,2R)-2-(hydroxymethyl)cyclohexyl]carbamic acid
CID 141194189

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide (CID 103751548) is N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide is O=C(NC1CCCC1CO)C1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide?
The InChIKey is SKGQFJIUZFKFCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c19-9-12-2-1-3-15(12)18-17(20)16-13-5-10-4-11(7-13)8-14(16)6-10/h10-16,19H,1-9H2,(H,18,20).
What are the key properties of N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide?
N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide has a molecular weight of 277.41 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclopentyl]adamantane-2-carboxamide is sourced from PubChem (CID 103751548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).