N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide

C6H12N2O3 — CID 100969877

IUPACN-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide
SMILESO=CCNCC(O)CNC=O
InChIInChI=1S/C6H12N2O3/c9-2-1-7-3-6(11)4-8-5-10/h2,5-7,11H,1,3-4H2,(H,8,10)
InChIKeyWYAXXSAUCPEXGR-UHFFFAOYSA-N
MW160.17 g/mol
LogP-2.12
Rot. Bonds7

About N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide

N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide (PubChem CID 100969877) has the molecular formula C6H12N2O3 and a molecular weight of 160.17 g/mol. Its IUPAC name is N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide.

Molecular Properties

Compound NameN-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide
PubChem CID100969877
Molecular FormulaC6H12N2O3
Molecular Weight160.17 g/mol
Exact Mass160.08
IUPAC NameN-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide
SMILESO=CCNCC(O)CNC=O
InChIInChI=1S/C6H12N2O3/c9-2-1-7-3-6(11)4-8-5-10/h2,5-7,11H,1,3-4H2,(H,8,10)
InChIKeyWYAXXSAUCPEXGR-UHFFFAOYSA-N
XLogP-2.12
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.17
LogP ≤ 5-2.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S)-3-formamido-2-hydroxypropanoic acid
CID 22855355
N-(2-hydroxy-3,3-dimethylbutyl)formamide
CID 130752227
N-[3-[formyl(2-methylpropyl)amino]-2-hydroxypropyl]formamide
CID 10608178
N-(4-hydroxy-2-methylpentyl)formamide
CID 130972750
3-formamido-2-hydroxy-N,N-dimethylpropanamide
CID 89251915
1-amino-2-formamidoethanesulfonic acid
CID 139212047
2-[(2-oxoethylamino)methylamino]acetaldehyde
CID 54207302
N-[2-(formamidomethyl)butyl]formamide
CID 59861734
formaldehyde;formamide;N-(hydroxymethyl)formamide;N-(2-oxoethyl)formamide
CID 158156764
N-[2-(hydroxymethyl)butyl]formamide
CID 130241467
N-[2-[2-(2-oxoethylamino)ethoxy]ethyl]formamide
CID 156882800
N-[3-methyl-2-(propan-2-ylamino)butyl]formamide
CID 170704985

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide?
The IUPAC name of N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide (CID 100969877) is N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide.
What is the SMILES notation for N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide?
The canonical SMILES for N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide is O=CCNCC(O)CNC=O.
What is the InChIKey of N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide?
The InChIKey is WYAXXSAUCPEXGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O3/c9-2-1-7-3-6(11)4-8-5-10/h2,5-7,11H,1,3-4H2,(H,8,10).
What are the key properties of N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide?
N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide has a molecular weight of 160.17 g/mol, XLogP of -2.12, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-3-(2-oxoethylamino)propyl]formamide is sourced from PubChem (CID 100969877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).