2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide

C13H25N3O2 — CID 63996539

IUPAC2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)NC(CC)CC1CC1
InChIInChI=1S/C13H25N3O2/c1-4-11(8-10-6-7-10)15-9(3)12(17)16-13(18)14-5-2/h9-11,15H,4-8H2,1-3H3,(H2,14,16,17,18)
InChIKeyFSQUTLYRSONPPP-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.39
Rot. Bonds7

About 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide

2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide (PubChem CID 63996539) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide
PubChem CID63996539
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)NC(CC)CC1CC1
InChIInChI=1S/C13H25N3O2/c1-4-11(8-10-6-7-10)15-9(3)12(17)16-13(18)14-5-2/h9-11,15H,4-8H2,1-3H3,(H2,14,16,17,18)
InChIKeyFSQUTLYRSONPPP-UHFFFAOYSA-N
XLogP1.39
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-cyclopropylbutan-2-ylamino)-N-(3-methylbutyl)propanamide
CID 63996720
2-(1-cyclopropylbutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide
CID 63995136
2-(cyclopentylmethylamino)-N-(ethylcarbamoyl)propanamide
CID 43317222
N-(ethylcarbamoyl)-2-[(1-hydroxy-3-methoxypropan-2-yl)amino]propanamide
CID 106190668
2-(cycloheptylamino)-N-(ethylcarbamoyl)propanamide
CID 43236392
N-(ethylcarbamoyl)-2-(2-hydroxyethylamino)propanamide
CID 43389341
N-(ethylcarbamoyl)-2-[(1-propylcyclopropyl)methylamino]propanamide
CID 113256759
N-(ethylcarbamoyl)-2-[(1-methylcyclopropyl)methylamino]propanamide
CID 103724729
2-[cyclopropyl(piperidin-4-ylmethyl)amino]-N-(ethylcarbamoyl)propanamide
CID 79703748
N-(ethylcarbamoyl)-2-(3-hydroxybutylamino)propanamide
CID 64913519
3-[[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]amino]propanoic acid
CID 43466733
N-(ethylcarbamoyl)-2-[(3-hydroxy-2-methylpropyl)amino]propanamide
CID 65036025

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide?
The IUPAC name of 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide (CID 63996539) is 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide.
What is the SMILES notation for 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide?
The canonical SMILES for 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide is CCNC(=O)NC(=O)C(C)NC(CC)CC1CC1.
What is the InChIKey of 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide?
The InChIKey is FSQUTLYRSONPPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-4-11(8-10-6-7-10)15-9(3)12(17)16-13(18)14-5-2/h9-11,15H,4-8H2,1-3H3,(H2,14,16,17,18).
What are the key properties of 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide?
2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide has a molecular weight of 255.36 g/mol, XLogP of 1.39, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropylbutan-2-ylamino)-N-(ethylcarbamoyl)propanamide is sourced from PubChem (CID 63996539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).