N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide

C17H26N2O — CID 60674399

IUPACN-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide
SMILESCC(C)CCNC(=O)CNC1CCc2ccccc2C1
InChIInChI=1S/C17H26N2O/c1-13(2)9-10-18-17(20)12-19-16-8-7-14-5-3-4-6-15(14)11-16/h3-6,13,16,19H,7-12H2,1-2H3,(H,18,20)
InChIKeyDKXAVWXJGJABTJ-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.30
Rot. Bonds6

About N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide

N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide (PubChem CID 60674399) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide.

Molecular Properties

Compound NameN-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide
PubChem CID60674399
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide
SMILESCC(C)CCNC(=O)CNC1CCc2ccccc2C1
InChIInChI=1S/C17H26N2O/c1-13(2)9-10-18-17(20)12-19-16-8-7-14-5-3-4-6-15(14)11-16/h3-6,13,16,19H,7-12H2,1-2H3,(H,18,20)
InChIKeyDKXAVWXJGJABTJ-UHFFFAOYSA-N
XLogP2.30
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclobutylamino)-N-(3-methylbutyl)acetamide
CID 62414172
2-[(6-bromo-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-N-(2-methylpropyl)acetamide
CID 115920101
2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide
CID 62305780
N,N-diphenyl-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide
CID 68968368
2-(2,3-dihydro-1-benzofuran-2-ylmethylamino)-N-(3-methylbutyl)acetamide
CID 61487190
2-chloro-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
CID 11775776
N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]propanamide
CID 68917081
2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
CID 112686633
N-pentyl-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide
CID 60719609
2-hydroxy-4-(1,2,3,4-tetrahydronaphthalen-2-ylcarbamoylamino)butanoic acid
CID 107839632
3-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide
CID 62305100
2-methyl-3-(methylamino)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
CID 79202769

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide?
The IUPAC name of N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide (CID 60674399) is N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide.
What is the SMILES notation for N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide?
The canonical SMILES for N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide is CC(C)CCNC(=O)CNC1CCc2ccccc2C1.
What is the InChIKey of N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide?
The InChIKey is DKXAVWXJGJABTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-13(2)9-10-18-17(20)12-19-16-8-7-14-5-3-4-6-15(14)11-16/h3-6,13,16,19H,7-12H2,1-2H3,(H,18,20).
What are the key properties of N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide?
N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide has a molecular weight of 274.41 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide is sourced from PubChem (CID 60674399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).