2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide

C9H17N3O2 — CID 79851893

IUPAC2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide
SMILESCC(NC(=O)CC1(N)CCC1)C(N)=O
InChIInChI=1S/C9H17N3O2/c1-6(8(10)14)12-7(13)5-9(11)3-2-4-9/h6H,2-5,11H2,1H3,(H2,10,14)(H,12,13)
InChIKeyWQDWPVSYXXHFER-UHFFFAOYSA-N
MW199.25 g/mol
LogP-0.75
Rot. Bonds4

About 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide

2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide (PubChem CID 79851893) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide.

Molecular Properties

Compound Name2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide
PubChem CID79851893
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide
SMILESCC(NC(=O)CC1(N)CCC1)C(N)=O
InChIInChI=1S/C9H17N3O2/c1-6(8(10)14)12-7(13)5-9(11)3-2-4-9/h6H,2-5,11H2,1H3,(H2,10,14)(H,12,13)
InChIKeyWQDWPVSYXXHFER-UHFFFAOYSA-N
XLogP-0.75
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-0.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(1-aminocyclopentyl)acetyl]amino]-N,N-dimethylpropanamide
CID 64685184
2-[[2-(1-aminocyclohexyl)acetyl]amino]-N-propylpropanamide
CID 64684814
2-(1-aminocyclobutyl)-N-(1-hydroxy-4-methylpentan-2-yl)acetamide
CID 79853679
2-(1-aminocyclopentyl)-N-(3-ethylpentan-2-yl)acetamide
CID 64676880
2-(1-aminocyclobutyl)-N-[1-(diethylamino)propan-2-yl]acetamide
CID 79854389
2-(1-aminocyclohexyl)-N-(1-cyclopentylethyl)acetamide
CID 64679071
2-(1-aminocyclohexyl)-N-[(1R)-1-cyclopentylethyl]acetamide
CID 81389349
2-(1-aminocyclohexyl)-N-(2-methylpentan-3-yl)acetamide
CID 64678828
2-(1-aminocyclobutyl)-N-(1-phenylethyl)acetamide
CID 79851717
(2S)-2-[[2-(1-aminocyclobutyl)acetyl]amino]-3-hydroxypropanoic acid
CID 79854103
2-(1-aminocyclobutyl)-N-(1-ethoxy-3-methylbutan-2-yl)acetamide
CID 114113758
2-(1-aminocyclopentyl)-N-(1-hydroxybutan-2-yl)acetamide
CID 64685767

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide?
The IUPAC name of 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide (CID 79851893) is 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide.
What is the SMILES notation for 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide?
The canonical SMILES for 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide is CC(NC(=O)CC1(N)CCC1)C(N)=O.
What is the InChIKey of 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide?
The InChIKey is WQDWPVSYXXHFER-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-6(8(10)14)12-7(13)5-9(11)3-2-4-9/h6H,2-5,11H2,1H3,(H2,10,14)(H,12,13).
What are the key properties of 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide?
2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide has a molecular weight of 199.25 g/mol, XLogP of -0.75, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(1-aminocyclobutyl)acetyl]amino]propanamide is sourced from PubChem (CID 79851893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).