2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide

C9H17N3O — CID 63761129

IUPAC2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide
SMILESCC(C(=O)NC1CC1)N1CC(N)C1
InChIInChI=1S/C9H17N3O/c1-6(12-4-7(10)5-12)9(13)11-8-2-3-8/h6-8H,2-5,10H2,1H3,(H,11,13)
InChIKeyKIOQIMYTYVGCQZ-UHFFFAOYSA-N
MW183.25 g/mol
LogP-0.70
Rot. Bonds3

About 2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide

2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide (PubChem CID 63761129) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide.

Molecular Properties

Compound Name2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide
PubChem CID63761129
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide
SMILESCC(C(=O)NC1CC1)N1CC(N)C1
InChIInChI=1S/C9H17N3O/c1-6(12-4-7(10)5-12)9(13)11-8-2-3-8/h6-8H,2-5,10H2,1H3,(H,11,13)
InChIKeyKIOQIMYTYVGCQZ-UHFFFAOYSA-N
XLogP-0.70
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-(3-hydroxyazetidin-1-yl)propanamide
CID 63282376
N-cyclopentyl-2-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]propanamide
CID 79411085
2-(3-aminoazetidin-1-yl)-N-(3-methylbutyl)propanamide
CID 63761130
2-(3-aminoazetidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 63761122
N-cyclopropyl-2-[4-(methylamino)piperidin-1-yl]propanamide
CID 60820306
2-(3-aminoazetidin-1-yl)-N-butylpropanamide
CID 63760897
N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide
CID 61204430
2-[4-(3-amino-2-methylbutanoyl)piperazin-1-yl]-N-cyclopropylpropanamide
CID 120502700
(2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-cyclopropylpropanamide
CID 99981545
2-[(3S,4R)-3-amino-4-phenylpyrrolidin-1-yl]-N-(4-methylcyclohexyl)propanamide
CID 120761631
2-[3-(2-aminoethyl)piperidin-1-yl]-N-cyclopentylpropanamide
CID 63764074
2-[4-(1-amino-1-sulfanylidenepentan-2-yl)piperazin-1-yl]-N-cyclopropylpropanamide
CID 63341629

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide?
The IUPAC name of 2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide (CID 63761129) is 2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide.
What is the SMILES notation for 2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide?
The canonical SMILES for 2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide is CC(C(=O)NC1CC1)N1CC(N)C1.
What is the InChIKey of 2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide?
The InChIKey is KIOQIMYTYVGCQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-6(12-4-7(10)5-12)9(13)11-8-2-3-8/h6-8H,2-5,10H2,1H3,(H,11,13).
What are the key properties of 2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide?
2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide has a molecular weight of 183.25 g/mol, XLogP of -0.70, 3 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-cyclopropylpropanamide is sourced from PubChem (CID 63761129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).