N-[1-(hydroxymethyl)cyclobutyl]nonanamide

C14H27NO2 — CID 115878113

IUPACN-[1-(hydroxymethyl)cyclobutyl]nonanamide
SMILESCCCCCCCCC(=O)NC1(CO)CCC1
InChIInChI=1S/C14H27NO2/c1-2-3-4-5-6-7-9-13(17)15-14(12-16)10-8-11-14/h16H,2-12H2,1H3,(H,15,17)
InChIKeyAMVZMXXAIQUJHF-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.77
Rot. Bonds9

About N-[1-(hydroxymethyl)cyclobutyl]nonanamide

N-[1-(hydroxymethyl)cyclobutyl]nonanamide (PubChem CID 115878113) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclobutyl]nonanamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclobutyl]nonanamide
PubChem CID115878113
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-[1-(hydroxymethyl)cyclobutyl]nonanamide
SMILESCCCCCCCCC(=O)NC1(CO)CCC1
InChIInChI=1S/C14H27NO2/c1-2-3-4-5-6-7-9-13(17)15-14(12-16)10-8-11-14/h16H,2-12H2,1H3,(H,15,17)
InChIKeyAMVZMXXAIQUJHF-UHFFFAOYSA-N
XLogP2.77
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[1-(hydroxymethyl)cyclopentyl]heptanamide
CID 62518617
N-[1-(hydroxymethyl)cyclopropyl]pentanamide
CID 115764875
2-[1-(hexanoylamino)cyclobutyl]acetic acid
CID 79848224
N-[1-(hydroxymethyl)-4-methylcyclohexyl]decanamide
CID 63404095
N-[1-(bromomethyl)cyclopentyl]hexanamide
CID 114311357
6-amino-N-[1-(hydroxymethyl)cyclohexyl]hexanamide
CID 55086608
N-[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxan-5-yl]octadecanamide
CID 129305066
1-(nonanoylamino)cyclohexane-1-carboxylic acid
CID 43350921
1-(nonanoylamino)cycloheptane-1-carboxylic acid
CID 43172633
N-[1-(chloromethyl)-3-methylcyclohexyl]nonanamide
CID 114304010
3-acetamido-N-[1-(hydroxymethyl)cyclobutyl]propanamide
CID 115878572
1-(hexanoylamino)cycloheptane-1-carboxylic acid
CID 43341577

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclobutyl]nonanamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclobutyl]nonanamide (CID 115878113) is N-[1-(hydroxymethyl)cyclobutyl]nonanamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclobutyl]nonanamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclobutyl]nonanamide is CCCCCCCCC(=O)NC1(CO)CCC1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclobutyl]nonanamide?
The InChIKey is AMVZMXXAIQUJHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-2-3-4-5-6-7-9-13(17)15-14(12-16)10-8-11-14/h16H,2-12H2,1H3,(H,15,17).
What are the key properties of N-[1-(hydroxymethyl)cyclobutyl]nonanamide?
N-[1-(hydroxymethyl)cyclobutyl]nonanamide has a molecular weight of 241.37 g/mol, XLogP of 2.77, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclobutyl]nonanamide is sourced from PubChem (CID 115878113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).