2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide

C10H21N3O3 — CID 112673608

IUPAC2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NOCC(N)=O
InChIInChI=1S/C10H21N3O3/c1-3-4-5-6-12-10(15)8(2)13-16-7-9(11)14/h8,13H,3-7H2,1-2H3,(H2,11,14)(H,12,15)
InChIKeyFPBIVQHVLDUAGO-UHFFFAOYSA-N
MW231.30 g/mol
LogP-0.31
Rot. Bonds9

About 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide

2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide (PubChem CID 112673608) has the molecular formula C10H21N3O3 and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide
PubChem CID112673608
Molecular FormulaC10H21N3O3
Molecular Weight231.30 g/mol
Exact Mass231.16
IUPAC Name2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NOCC(N)=O
InChIInChI=1S/C10H21N3O3/c1-3-4-5-6-12-10(15)8(2)13-16-7-9(11)14/h8,13H,3-7H2,1-2H3,(H2,11,14)(H,12,15)
InChIKeyFPBIVQHVLDUAGO-UHFFFAOYSA-N
XLogP-0.31
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 5-0.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(2-amino-2-oxoethoxy)amino]-N-(3-methoxypropyl)propanamide
CID 112673851
N-pentyl-2-(2,2,2-trifluoroethoxyamino)propanamide
CID 82722236
2-[(2-amino-2-oxoethoxy)amino]-N-methylpropanamide
CID 112673732
2-[(3-amino-3-oxopropyl)amino]-N-pentylpropanamide
CID 43553504
2-(nonan-2-ylamino)oxyacetamide
CID 112672908
2-[(2-methylpropan-2-yl)oxyamino]-N-pentylpropanamide
CID 82724423
2-[[1-oxo-1-(pentylamino)propan-2-yl]amino]ethyl carbamate
CID 83210164
pentylurea;hydrate
CID 172845599
(2S)-2-amino-3-methyl-N-pentylpentanamide
CID 22690936
N-hexyl-2-[1-(hexylamino)-1-oxopropan-2-yl]oxypropanamide
CID 175959027
(2S)-2-amino-3-methyl-N-octadecylpentanamide
CID 58604652
2-(3-methoxypropylamino)-N-pentylpropanamide
CID 43131874

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide?
The IUPAC name of 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide (CID 112673608) is 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide.
What is the SMILES notation for 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide?
The canonical SMILES for 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide is CCCCCNC(=O)C(C)NOCC(N)=O.
What is the InChIKey of 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide?
The InChIKey is FPBIVQHVLDUAGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3/c1-3-4-5-6-12-10(15)8(2)13-16-7-9(11)14/h8,13H,3-7H2,1-2H3,(H2,11,14)(H,12,15).
What are the key properties of 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide?
2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide has a molecular weight of 231.30 g/mol, XLogP of -0.31, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-oxoethoxy)amino]-N-pentylpropanamide is sourced from PubChem (CID 112673608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).