N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide

C14H25NO2 — CID 79199997

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide
SMILESCN(CC1CC2CCC1C2)C(=O)CCCCO
InChIInChI=1S/C14H25NO2/c1-15(14(17)4-2-3-7-16)10-13-9-11-5-6-12(13)8-11/h11-13,16H,2-10H2,1H3
InChIKeyGGXWZMBUNZKQSY-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.04
Rot. Bonds6

About N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide

N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide (PubChem CID 79199997) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide
PubChem CID79199997
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide
SMILESCN(CC1CC2CCC1C2)C(=O)CCCCO
InChIInChI=1S/C14H25NO2/c1-15(14(17)4-2-3-7-16)10-13-9-11-5-6-12(13)8-11/h11-13,16H,2-10H2,1H3
InChIKeyGGXWZMBUNZKQSY-UHFFFAOYSA-N
XLogP2.04
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]-3-oxopropanoic acid
CID 63685758
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylacetamide
CID 79611059
4-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-methoxy-N-methylbutanamide
CID 103155894
3-[[2-bicyclo[2.2.1]heptanylmethyl(methyl)carbamoyl]-cyclopropylamino]propanoic acid
CID 63682050
2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylbutanamide
CID 63683674
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methoxy-N,2-dimethylpropanamide
CID 103029139
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-bromo-N-methylbutanamide
CID 63681740
1-(2-bicyclo[2.2.1]heptanylmethyl)-3-cyclobutyl-1-methylurea
CID 116656057
N-[2-bicyclo[2.2.1]heptanylmethyl(methyl)carbamoyl]-3-chloropropanamide
CID 55233841
N-(3-aminopropyl)-2-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]-N-methylacetamide
CID 55233822
2-(2-bicyclo[2.2.1]heptanyl)-N,N-dimethylacetamide
CID 42910279
(2S)-2-amino-N-[2-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]-2-oxoethyl]-3-methylbutanamide
CID 82964218

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide (CID 79199997) is N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide is CN(CC1CC2CCC1C2)C(=O)CCCCO.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide?
The InChIKey is GGXWZMBUNZKQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-15(14(17)4-2-3-7-16)10-13-9-11-5-6-12(13)8-11/h11-13,16H,2-10H2,1H3.
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide?
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide has a molecular weight of 239.36 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylmethyl)-5-hydroxy-N-methylpentanamide is sourced from PubChem (CID 79199997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).