ethane;ethanol;2-formamidoacetic acid;propane

C10H25NO4 — CID 143106898

IUPACethane;ethanol;2-formamidoacetic acid;propane
SMILESCC.CCC.CCO.O=CNCC(=O)O
InChIInChI=1S/C3H5NO3.C3H8.C2H6O.C2H6/c5-2-4-1-3(6)7;1-3-2;1-2-3;1-2/h2H,1H2,(H,4,5)(H,6,7);3H2,1-2H3;3H,2H2,1H3;1-2H3
InChIKeyPBYUNRKZDTYRCW-UHFFFAOYSA-N
MW223.31 g/mol
LogP1.26
Rot. Bonds3

About ethane;ethanol;2-formamidoacetic acid;propane

ethane;ethanol;2-formamidoacetic acid;propane (PubChem CID 143106898) has the molecular formula C10H25NO4 and a molecular weight of 223.31 g/mol. Its IUPAC name is ethane;ethanol;2-formamidoacetic acid;propane.

Molecular Properties

Compound Nameethane;ethanol;2-formamidoacetic acid;propane
PubChem CID143106898
Molecular FormulaC10H25NO4
Molecular Weight223.31 g/mol
Exact Mass223.18
IUPAC Nameethane;ethanol;2-formamidoacetic acid;propane
SMILESCC.CCC.CCO.O=CNCC(=O)O
InChIInChI=1S/C3H5NO3.C3H8.C2H6O.C2H6/c5-2-4-1-3(6)7;1-3-2;1-2-3;1-2/h2H,1H2,(H,4,5)(H,6,7);3H2,1-2H3;3H,2H2,1H3;1-2H3
InChIKeyPBYUNRKZDTYRCW-UHFFFAOYSA-N
XLogP1.26
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.31
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-formamidoacetic acid
CID 170552381
2-formamidoacetic acid;hydrochloride
CID 174363412
ethane;1-ethylpyrrolidine;2-formamidoacetic acid
CID 162750757
ethane;2-formamidoacetic acid;(4-methylphenyl)hydrazine
CID 142273744
N-ethyl-2-formamidoacetamide
CID 14481878
N-(2-hydroxyprop-2-enyl)formamide
CID 87223348
2-[[(E)-2-methoxyethenyl]amino]acetic acid
CID 87073371
2-[[2-[(2-formamidoacetyl)-propylamino]acetyl]amino]acetic acid
CID 145155015
N-[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]-2-(propan-2-ylamino)acetamide;2-[[2-[[2-[[2-[(2-formamidoacetyl)amino]acetyl]amino]acetyl]amino]acetyl]amino]acetic acid
CID 176672107
2-(2,2-dihydroxyethenylamino)acetic acid
CID 58720984
N-(3-methyl-2-oxobutyl)formamide
CID 64997253
2-(carboxymethylamino)acetic acid
CID 8897

Frequently Asked Questions

What is the IUPAC name of ethane;ethanol;2-formamidoacetic acid;propane?
The IUPAC name of ethane;ethanol;2-formamidoacetic acid;propane (CID 143106898) is ethane;ethanol;2-formamidoacetic acid;propane.
What is the SMILES notation for ethane;ethanol;2-formamidoacetic acid;propane?
The canonical SMILES for ethane;ethanol;2-formamidoacetic acid;propane is CC.CCC.CCO.O=CNCC(=O)O.
What is the InChIKey of ethane;ethanol;2-formamidoacetic acid;propane?
The InChIKey is PBYUNRKZDTYRCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5NO3.C3H8.C2H6O.C2H6/c5-2-4-1-3(6)7;1-3-2;1-2-3;1-2/h2H,1H2,(H,4,5)(H,6,7);3H2,1-2H3;3H,2H2,1H3;1-2H3.
What are the key properties of ethane;ethanol;2-formamidoacetic acid;propane?
ethane;ethanol;2-formamidoacetic acid;propane has a molecular weight of 223.31 g/mol, XLogP of 1.26, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethanol;2-formamidoacetic acid;propane is sourced from PubChem (CID 143106898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).