2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide

C11H23N3O — CID 63761130

IUPAC2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide
SMILESCC(C)CCNC(=O)C(C)N1CC(N)C1
InChIInChI=1S/C11H23N3O/c1-8(2)4-5-13-11(15)9(3)14-6-10(12)7-14/h8-10H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyBZUDMOCSGJCPNQ-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.18
Rot. Bonds5

About 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide

2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide (PubChem CID 63761130) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide.

Molecular Properties

Compound Name2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide
PubChem CID63761130
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide
SMILESCC(C)CCNC(=O)C(C)N1CC(N)C1
InChIInChI=1S/C11H23N3O/c1-8(2)4-5-13-11(15)9(3)14-6-10(12)7-14/h8-10H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyBZUDMOCSGJCPNQ-UHFFFAOYSA-N
XLogP0.18
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminoazetidin-1-yl)-N-butylpropanamide
CID 63760897
2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide
CID 55149467
2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-(3-methylbutyl)propanamide
CID 78963745
2-[4-(methylamino)piperidin-1-yl]-N-(3-methylbutyl)propanamide
CID 60820308
2-(3-aminopyrrolidin-1-yl)-N-butylpropanamide
CID 62068647
2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide
CID 63761129
2-[3-(1-aminoethyl)piperidin-1-yl]-N-(3-methylbutyl)propanamide
CID 55258927
2-(3-aminoazetidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 63761122
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 115302045
2-(3,4-dihydroxypyrrolidin-1-yl)-N-(2-methylpropyl)propanamide
CID 106672398
2-[(3R)-3-aminopiperidin-1-yl]-N-ethylpropanamide
CID 102977439
2-(3-amino-4-methylpyrrolidin-1-yl)-N-(3-methoxypropyl)propanamide
CID 103577229

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide?
The IUPAC name of 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide (CID 63761130) is 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide.
What is the SMILES notation for 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide?
The canonical SMILES for 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide is CC(C)CCNC(=O)C(C)N1CC(N)C1.
What is the InChIKey of 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide?
The InChIKey is BZUDMOCSGJCPNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-8(2)4-5-13-11(15)9(3)14-6-10(12)7-14/h8-10H,4-7,12H2,1-3H3,(H,13,15).
What are the key properties of 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide?
2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide has a molecular weight of 213.32 g/mol, XLogP of 0.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide is sourced from PubChem (CID 63761130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).