N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide

C9H14N2O3 — CID 3155965

IUPACN-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide
SMILESO=C(NCCNCCO)c1ccco1
InChIInChI=1S/C9H14N2O3/c12-6-5-10-3-4-11-9(13)8-2-1-7-14-8/h1-2,7,10,12H,3-6H2,(H,11,13)
InChIKeyMRWQERNLCBNQRQ-UHFFFAOYSA-N
MW198.22 g/mol
LogP-0.41
Rot. Bonds6

About N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide

N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide (PubChem CID 3155965) has the molecular formula C9H14N2O3 and a molecular weight of 198.22 g/mol. Its IUPAC name is N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide
PubChem CID3155965
Molecular FormulaC9H14N2O3
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC NameN-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide
SMILESO=C(NCCNCCO)c1ccco1
InChIInChI=1S/C9H14N2O3/c12-6-5-10-3-4-11-9(13)8-2-1-7-14-8/h1-2,7,10,12H,3-6H2,(H,11,13)
InChIKeyMRWQERNLCBNQRQ-UHFFFAOYSA-N
XLogP-0.41
TPSA74.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[10-(furan-2-carbonylamino)decyl]furan-2-carboxamide
CID 3147438
N-[2-[(2-chloroacetyl)amino]ethyl]furan-2-carboxamide
CID 108571159
3-(furan-2-carbonylamino)propanoic acid
CID 762504
N-[2-(3-phenylbutylamino)ethyl]furan-2-carboxamide
CID 119142073
N-[2-(3-aminopropanoylamino)ethyl]furan-2-carboxamide;hydrochloride
CID 119278257
N-[3-(ethylamino)propyl]furan-2-carboxamide
CID 43601657
N-[2-(3-chloropropanoylamino)ethyl]furan-2-carboxamide
CID 108571149
N-(3-formamidopropyl)furan-2-carboxamide
CID 110461151
N-[2-[(4-ethylphenyl)methylamino]ethyl]furan-2-carboxamide;oxalic acid
CID 56603517
N-(4-aminobutyl)furan-2-carboxamide
CID 14423349
N-(3-amino-3-sulfanylidenepropyl)furan-2-carboxamide
CID 62665546
N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide
CID 30797782

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide (CID 3155965) is N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide is O=C(NCCNCCO)c1ccco1.
What is the InChIKey of N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide?
The InChIKey is MRWQERNLCBNQRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3/c12-6-5-10-3-4-11-9(13)8-2-1-7-14-8/h1-2,7,10,12H,3-6H2,(H,11,13).
What are the key properties of N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide?
N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide has a molecular weight of 198.22 g/mol, XLogP of -0.41, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyethylamino)ethyl]furan-2-carboxamide is sourced from PubChem (CID 3155965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).