2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide

C11H21N3O2 — CID 115585441

IUPAC2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide
SMILESCC(NC(=O)NC(C)(C)C)C(=O)NC1CC1
InChIInChI=1S/C11H21N3O2/c1-7(9(15)13-8-5-6-8)12-10(16)14-11(2,3)4/h7-8H,5-6H2,1-4H3,(H,13,15)(H2,12,14,16)
InChIKeyBZTJYYMXHWEAIY-UHFFFAOYSA-N
MW227.31 g/mol
LogP0.75
Rot. Bonds3

About 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide

2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide (PubChem CID 115585441) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide.

Molecular Properties

Compound Name2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide
PubChem CID115585441
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide
SMILESCC(NC(=O)NC(C)(C)C)C(=O)NC1CC1
InChIInChI=1S/C11H21N3O2/c1-7(9(15)13-8-5-6-8)12-10(16)14-11(2,3)4/h7-8H,5-6H2,1-4H3,(H,13,15)(H2,12,14,16)
InChIKeyBZTJYYMXHWEAIY-UHFFFAOYSA-N
XLogP0.75
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-2-(cyclopropylcarbamoylamino)propanamide
CID 116657682
(2S)-2-(tert-butylcarbamoylamino)-N-cyclopropyl-3,3-dimethylbutanamide
CID 173105917
N-cyclopentyl-2-(cyclopropylcarbamoylamino)propanamide
CID 47076626
2-(tert-butylcarbamoylamino)-N-propan-2-ylpropanamide
CID 116657668
N-[1-(cyclopropylamino)-1-oxopropan-2-yl]-2-methylpropanamide
CID 115599512
1-tert-butyl-3-[(2S)-3,3-dimethylbutan-2-yl]urea
CID 159105073
N-cyclopropyl-2-(cyclopropylcarbamothioylamino)propanamide
CID 116509918
1-tert-butyl-3-cyclobutylurea
CID 17217146
2-(cyclopropylcarbamoylamino)-N-ethylpropanamide
CID 115575153
N-tert-butyl-2-[[2-(cyclopropylamino)acetyl]amino]propanamide
CID 112703978
(2R)-N-tert-butyl-2-[(1-prop-2-enylpiperidin-4-yl)carbamoylamino]propanamide
CID 95759967
1-tert-butyl-3-(4-oxocyclohexyl)urea
CID 43652951

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide?
The IUPAC name of 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide (CID 115585441) is 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide.
What is the SMILES notation for 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide?
The canonical SMILES for 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide is CC(NC(=O)NC(C)(C)C)C(=O)NC1CC1.
What is the InChIKey of 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide?
The InChIKey is BZTJYYMXHWEAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-7(9(15)13-8-5-6-8)12-10(16)14-11(2,3)4/h7-8H,5-6H2,1-4H3,(H,13,15)(H2,12,14,16).
What are the key properties of 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide?
2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide has a molecular weight of 227.31 g/mol, XLogP of 0.75, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylcarbamoylamino)-N-cyclopropylpropanamide is sourced from PubChem (CID 115585441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).