N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide

C15H24N2O4 — CID 103725537

IUPACN-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide
SMILESCCCC(CCO)CNC(=O)CCNC(=O)c1ccoc1
InChIInChI=1S/C15H24N2O4/c1-2-3-12(5-8-18)10-17-14(19)4-7-16-15(20)13-6-9-21-11-13/h6,9,11-12,18H,2-5,7-8,10H2,1H3,(H,16,20)(H,17,19)
InChIKeyMSQSRMXZFFRGIJ-UHFFFAOYSA-N
MW296.37 g/mol
LogP1.31
Rot. Bonds10

About N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide

N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide (PubChem CID 103725537) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide
PubChem CID103725537
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC NameN-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide
SMILESCCCC(CCO)CNC(=O)CCNC(=O)c1ccoc1
InChIInChI=1S/C15H24N2O4/c1-2-3-12(5-8-18)10-17-14(19)4-7-16-15(20)13-6-9-21-11-13/h6,9,11-12,18H,2-5,7-8,10H2,1H3,(H,16,20)(H,17,19)
InChIKeyMSQSRMXZFFRGIJ-UHFFFAOYSA-N
XLogP1.31
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(3-hydroxypropylamino)-3-oxopropyl]furan-3-carboxamide
CID 43427988
(2S)-2-[3-(furan-3-carbonylamino)propanoylamino]-4-hydroxybutanoic acid
CID 107822062
2-[3-(furan-3-carbonylamino)propanoylamino]-4-hydroxybutanoic acid
CID 61243124
N-[3-[(1-hydroxy-4,4-dimethylpentan-3-yl)amino]-3-oxopropyl]furan-3-carboxamide
CID 106353047
ethyl N-[1-[3-(furan-3-carbonylamino)propanoylamino]-4-methylpentan-2-yl]carbamate
CID 46432538
N-pentylfuran-3-carboxamide
CID 91139562
3-(tert-butylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide
CID 114145527
N-[3-[[2-(2-chlorophenyl)-2-(diethylamino)ethyl]amino]-3-oxopropyl]furan-3-carboxamide
CID 46430168
N-[2-(2-hydroxyethyl)pentyl]-3-phenylpropanamide
CID 103722786
N-decylfuran-3-carboxamide
CID 117059205
(2S)-2-[3-(furan-3-carbonylamino)propanoylamino]-3-methylbutanoic acid
CID 61136349
N-[3-[[(2R)-3-(3,5-dimethylpyrazol-1-yl)-2-methylpropyl]amino]-3-oxopropyl]furan-3-carboxamide
CID 94003270

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide?
The IUPAC name of N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide (CID 103725537) is N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide.
What is the SMILES notation for N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide?
The canonical SMILES for N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide is CCCC(CCO)CNC(=O)CCNC(=O)c1ccoc1.
What is the InChIKey of N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide?
The InChIKey is MSQSRMXZFFRGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-2-3-12(5-8-18)10-17-14(19)4-7-16-15(20)13-6-9-21-11-13/h6,9,11-12,18H,2-5,7-8,10H2,1H3,(H,16,20)(H,17,19).
What are the key properties of N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide?
N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 1.31, 10 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(2-hydroxyethyl)pentylamino]-3-oxopropyl]furan-3-carboxamide is sourced from PubChem (CID 103725537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).