2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide

C11H21N3O3 — CID 102870196

IUPAC2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)N(CCO)C1CCC1
InChIInChI=1S/C11H21N3O3/c1-8(10(16)13-11(17)12-2)14(6-7-15)9-4-3-5-9/h8-9,15H,3-7H2,1-2H3,(H2,12,13,16,17)
InChIKeyMNVJTNBXOCMKSX-UHFFFAOYSA-N
MW243.31 g/mol
LogP-0.32
Rot. Bonds5

About 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide

2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide (PubChem CID 102870196) has the molecular formula C11H21N3O3 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide
PubChem CID102870196
Molecular FormulaC11H21N3O3
Molecular Weight243.31 g/mol
Exact Mass243.16
IUPAC Name2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)N(CCO)C1CCC1
InChIInChI=1S/C11H21N3O3/c1-8(10(16)13-11(17)12-2)14(6-7-15)9-4-3-5-9/h8-9,15H,3-7H2,1-2H3,(H2,12,13,16,17)
InChIKeyMNVJTNBXOCMKSX-UHFFFAOYSA-N
XLogP-0.32
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[cyclopropyl-[1-(methylcarbamoylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 54945067
2-[cyclopentyl(2-hydroxyethyl)amino]-N-pentylpropanamide
CID 62016618
2-[ethyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide
CID 60685692
2-[cyclobutyl(3-hydroxypropyl)amino]propanehydrazide
CID 102873675
2-[cyclopropyl(2-hydroxyethyl)amino]-N-pentan-2-ylpropanamide
CID 62021160
2-[2-aminoethyl(cyclopentyl)amino]-N-(ethylcarbamoyl)propanamide
CID 63761474
3-[cyclobutyl(2-hydroxyethyl)amino]-2-methylbutanehydrazide
CID 102873737
2-[cyclobutyl(2-hydroxyethyl)amino]-1-morpholin-4-ylpropan-1-one
CID 102870010
2-[cyclobutyl(3-hydroxypropyl)amino]-N-pentylpropanamide
CID 102858511
2-[cyclopentyl(propan-2-yl)amino]ethanol
CID 62020033
tert-butyl 2-[cyclopentyl(2-hydroxyethyl)amino]propanoate
CID 66339425
tert-butyl 2-[cyclohexyl(2-hydroxyethyl)amino]propanoate
CID 66339424

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide?
The IUPAC name of 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide (CID 102870196) is 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide.
What is the SMILES notation for 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide?
The canonical SMILES for 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide is CNC(=O)NC(=O)C(C)N(CCO)C1CCC1.
What is the InChIKey of 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide?
The InChIKey is MNVJTNBXOCMKSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3/c1-8(10(16)13-11(17)12-2)14(6-7-15)9-4-3-5-9/h8-9,15H,3-7H2,1-2H3,(H2,12,13,16,17).
What are the key properties of 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide?
2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide has a molecular weight of 243.31 g/mol, XLogP of -0.32, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl(2-hydroxyethyl)amino]-N-(methylcarbamoyl)propanamide is sourced from PubChem (CID 102870196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).