2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide

C15H29N3O — CID 55149467

IUPAC2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide
SMILESCC(C)CCNC(=O)C(C)N1C2CCC1CC(N)C2
InChIInChI=1S/C15H29N3O/c1-10(2)6-7-17-15(19)11(3)18-13-4-5-14(18)9-12(16)8-13/h10-14H,4-9,16H2,1-3H3,(H,17,19)
InChIKeyJXYVMMVMKNMLEA-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.49
Rot. Bonds5

About 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide

2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide (PubChem CID 55149467) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide.

Molecular Properties

Compound Name2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide
PubChem CID55149467
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide
SMILESCC(C)CCNC(=O)C(C)N1C2CCC1CC(N)C2
InChIInChI=1S/C15H29N3O/c1-10(2)6-7-17-15(19)11(3)18-13-4-5-14(18)9-12(16)8-13/h10-14H,4-9,16H2,1-3H3,(H,17,19)
InChIKeyJXYVMMVMKNMLEA-UHFFFAOYSA-N
XLogP1.49
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)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

2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide
CID 63761130
N-ethyl-2-[3-(methylamino)-8-azabicyclo[3.2.1]octan-8-yl]propanamide
CID 62738654
2-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)propanehydrazide
CID 63770170
2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide
CID 60820308
2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-(3-methylbutyl)propanamide
CID 78963745
1-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-3-methylbutan-1-one
CID 61233677
3-amino-N-(4-methylpentyl)cyclobutane-1-carboxamide
CID 115161643
2-[3-(1-aminoethyl)piperidin-1-yl]-N-(3-methylbutyl)propanamide
CID 55258927
2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-(3-methylbutyl)-2-oxoacetamide
CID 108522614
2-(3-aminoazetidin-1-yl)-N-butylpropanamide
CID 63760897
3-amino-4-methyl-N-(3-methylbutyl)cyclohexane-1-carboxamide
CID 62781322
2-(1-cyclopropylbutan-2-ylamino)-N-(3-methylbutyl)propanamide
CID 63996720

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide?
The IUPAC name of 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide (CID 55149467) is 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide.
What is the SMILES notation for 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide?
The canonical SMILES for 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide is CC(C)CCNC(=O)C(C)N1C2CCC1CC(N)C2.
What is the InChIKey of 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide?
The InChIKey is JXYVMMVMKNMLEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-10(2)6-7-17-15(19)11(3)18-13-4-5-14(18)9-12(16)8-13/h10-14H,4-9,16H2,1-3H3,(H,17,19).
What are the key properties of 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide?
2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide has a molecular weight of 267.42 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide is sourced from PubChem (CID 55149467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).