3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide

C16H23NO — CID 144973530

IUPAC3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide
SMILESCCC(C)CC(=O)N[C@@H]1CCCc2ccccc21
InChIInChI=1S/C16H23NO/c1-3-12(2)11-16(18)17-15-10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9,12,15H,3,6,8,10-11H2,1-2H3,(H,17,18)/t12?,15-/m1/s1
InChIKeyAKLHWWMXVDBVRG-WPZCJLIBSA-N
MW245.37 g/mol
LogP3.62
Rot. Bonds4

About 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide

3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide (PubChem CID 144973530) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide.

Molecular Properties

Compound Name3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide
PubChem CID144973530
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide
SMILESCCC(C)CC(=O)N[C@@H]1CCCc2ccccc21
InChIInChI=1S/C16H23NO/c1-3-12(2)11-16(18)17-15-10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9,12,15H,3,6,8,10-11H2,1-2H3,(H,17,18)/t12?,15-/m1/s1
InChIKeyAKLHWWMXVDBVRG-WPZCJLIBSA-N
XLogP3.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-amino-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide
CID 81076134
3-methyl-N-(4-propan-2-ylphenyl)-N'-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanediamide
CID 5137610
(3R)-3-methyl-N-(4-propan-2-ylphenyl)-N'-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanediamide
CID 7321311
5-(2,3-dihydro-1H-inden-1-ylamino)-3-methyl-5-oxopentanoic acid
CID 55155027
N-[(2R)-4-oxo-4-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]butan-2-yl]benzamide
CID 32745629
3-amino-3-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 119948742
4-amino-3-methoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)butanamide;hydrochloride
CID 120586516
N-cyclopropyl-2-[methyl-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]amino]acetamide
CID 9053146
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]dodecanamide
CID 23624795
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 8712235
methyl-[2-oxo-2-(propan-2-ylamino)ethyl]-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]azanium
CID 9049425
2-[[(1S)-1-phenylethyl]amino]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 8898721

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide?
The IUPAC name of 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide (CID 144973530) is 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide.
What is the SMILES notation for 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide?
The canonical SMILES for 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide is CCC(C)CC(=O)N[C@@H]1CCCc2ccccc21.
What is the InChIKey of 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide?
The InChIKey is AKLHWWMXVDBVRG-WPZCJLIBSA-N. The full InChI is InChI=1S/C16H23NO/c1-3-12(2)11-16(18)17-15-10-6-8-13-7-4-5-9-14(13)15/h4-5,7,9,12,15H,3,6,8,10-11H2,1-2H3,(H,17,18)/t12?,15-/m1/s1.
What are the key properties of 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide?
3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide has a molecular weight of 245.37 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pentanamide is sourced from PubChem (CID 144973530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).