2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide

C14H20N2O — CID 62305780

IUPAC2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide
SMILESCC(CNC1CCc2ccccc2C1)C(N)=O
InChIInChI=1S/C14H20N2O/c1-10(14(15)17)9-16-13-7-6-11-4-2-3-5-12(11)8-13/h2-5,10,13,16H,6-9H2,1H3,(H2,15,17)
InChIKeyUTQKIYIUBOAVPA-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.25
Rot. Bonds4

About 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide

2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide (PubChem CID 62305780) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide.

Molecular Properties

Compound Name2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide
PubChem CID62305780
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide
SMILESCC(CNC1CCc2ccccc2C1)C(N)=O
InChIInChI=1S/C14H20N2O/c1-10(14(15)17)9-16-13-7-6-11-4-2-3-5-12(11)8-13/h2-5,10,13,16H,6-9H2,1H3,(H2,15,17)
InChIKeyUTQKIYIUBOAVPA-UHFFFAOYSA-N
XLogP1.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,3-dihydro-1H-inden-1-ylamino)-2-methylpropanamide
CID 43652107
2-methyl-3-(methylamino)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
CID 79202769
2-N,2-N,3-trimethyl-1-N-(1,2,3,4-tetrahydronaphthalen-2-yl)butane-1,2-diamine
CID 43434687
4-(1,2,3,4-tetrahydronaphthalen-2-ylamino)cyclohexane-1-carboxamide
CID 43791690
(2R)-2-amino-N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide;hydrochloride
CID 119270502
1-(dimethylamino)-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propan-2-ol
CID 62305455
N-(3-methylbutyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)acetamide
CID 60674399
2-amino-3-methoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
CID 81089612
1-(2-methoxyphenoxy)-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propan-2-ol
CID 14751044
2-amino-N-(1,2,3,4-tetrahydronaphthalen-2-yl)hexanamide
CID 62305097
N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]propanamide
CID 68917081
propan-2-yl N-(1,2,3,4-tetrahydronaphthalen-2-yl)carbamate
CID 116655524

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide?
The IUPAC name of 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide (CID 62305780) is 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide.
What is the SMILES notation for 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide?
The canonical SMILES for 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide is CC(CNC1CCc2ccccc2C1)C(N)=O.
What is the InChIKey of 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide?
The InChIKey is UTQKIYIUBOAVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10(14(15)17)9-16-13-7-6-11-4-2-3-5-12(11)8-13/h2-5,10,13,16H,6-9H2,1H3,(H2,15,17).
What are the key properties of 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide?
2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide has a molecular weight of 232.33 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide is sourced from PubChem (CID 62305780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).