N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide

C17H26N2O — CID 81334511

IUPACN-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide
SMILESCCC(C)NC(=O)CCNC1CCc2ccc(C)cc21
InChIInChI=1S/C17H26N2O/c1-4-13(3)19-17(20)9-10-18-16-8-7-14-6-5-12(2)11-15(14)16/h5-6,11,13,16,18H,4,7-10H2,1-3H3,(H,19,20)
InChIKeyGTEJYAFUSNFFSY-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.88
Rot. Bonds6

About N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide

N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide (PubChem CID 81334511) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide.

Molecular Properties

Compound NameN-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide
PubChem CID81334511
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide
SMILESCCC(C)NC(=O)CCNC1CCc2ccc(C)cc21
InChIInChI=1S/C17H26N2O/c1-4-13(3)19-17(20)9-10-18-16-8-7-14-6-5-12(2)11-15(14)16/h5-6,11,13,16,18H,4,7-10H2,1-3H3,(H,19,20)
InChIKeyGTEJYAFUSNFFSY-UHFFFAOYSA-N
XLogP2.88
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 ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(5-amino-2,3-dihydro-1H-inden-1-yl)amino]-N-butan-2-ylpropanamide
CID 79730548
5-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]pentanamide
CID 114161832
N-butan-2-yl-2-(2,3-dihydro-1H-inden-1-ylamino)acetamide
CID 43424190
4-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]butan-1-ol
CID 106840528
N-butan-2-yl-3-[(2-chloro-4,5,6,7-tetrahydro-1-benzothiophen-4-yl)amino]propanamide
CID 82689739
6-methyl-N-(3-methylsulfanylbutyl)-2,3-dihydro-1H-inden-1-amine
CID 115716161
N-butan-2-yl-3-[[3-(3-methylphenyl)cyclobutyl]amino]propanamide
CID 61021464
6-methyl-N-(2-pyrrolidin-1-ylethyl)-2,3-dihydro-1H-inden-1-amine
CID 81301273
N-butan-2-yl-3-[(2-iodo-4,5,6,7-tetrahydro-1-benzothiophen-4-yl)amino]propanamide
CID 82689664
3-[[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]methyl]pentan-1-ol
CID 81343671
(1S)-N-(2-methoxyethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 97357930
tert-butyl N-[1-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]butan-2-yl]carbamate
CID 107250248

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide?
The IUPAC name of N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide (CID 81334511) is N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide.
What is the SMILES notation for N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide?
The canonical SMILES for N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide is CCC(C)NC(=O)CCNC1CCc2ccc(C)cc21.
What is the InChIKey of N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide?
The InChIKey is GTEJYAFUSNFFSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-13(3)19-17(20)9-10-18-16-8-7-14-6-5-12(2)11-15(14)16/h5-6,11,13,16,18H,4,7-10H2,1-3H3,(H,19,20).
What are the key properties of N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide?
N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide has a molecular weight of 274.41 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide is sourced from PubChem (CID 81334511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).