2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide

C8H17N3O2 — CID 60703127

IUPAC2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)C(N)=O
InChIInChI=1S/C8H17N3O2/c1-4-11(8(9)13)5-7(12)10-6(2)3/h6H,4-5H2,1-3H3,(H2,9,13)(H,10,12)
InChIKeyFWORZCWWKOFSLO-UHFFFAOYSA-N
MW187.24 g/mol
LogP-0.09
Rot. Bonds4

About 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide

2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide (PubChem CID 60703127) has the molecular formula C8H17N3O2 and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide
PubChem CID60703127
Molecular FormulaC8H17N3O2
Molecular Weight187.24 g/mol
Exact Mass187.13
IUPAC Name2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)C(N)=O
InChIInChI=1S/C8H17N3O2/c1-4-11(8(9)13)5-7(12)10-6(2)3/h6H,4-5H2,1-3H3,(H2,9,13)(H,10,12)
InChIKeyFWORZCWWKOFSLO-UHFFFAOYSA-N
XLogP-0.09
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]carbamate
CID 60652174
3-amino-N-ethyl-2-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 113416182
(2R)-2-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 79012433
(2R)-2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
CID 93367275
7-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]heptanamide
CID 54869086
N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-(propan-2-ylamino)propanamide
CID 54869110
3-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-2,2-dimethyl-3-oxopropanoic acid
CID 82821282
N-ethyl-1-(N'-hydroxycarbamimidoyl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopropane-1-carboxamide
CID 80596725
(2R)-2-[[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]amino]-3-methylbutanoic acid
CID 79010051
2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
CID 64824749
2-(3-aminoazetidin-1-yl)-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 65249916
3-[[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]amino]-2-methoxypropanoic acid
CID 106109941

Frequently Asked Questions

What is the IUPAC name of 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide (CID 60703127) is 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide is CCN(CC(=O)NC(C)C)C(N)=O.
What is the InChIKey of 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide?
The InChIKey is FWORZCWWKOFSLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2/c1-4-11(8(9)13)5-7(12)10-6(2)3/h6H,4-5H2,1-3H3,(H2,9,13)(H,10,12).
What are the key properties of 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide?
2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide has a molecular weight of 187.24 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 60703127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).