N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide

C25H30N6O4 — CID 10310972

IUPACN-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide
SMILESO=C(NO)c1cnc(N2CCN(Cc3ccc(-c4ccc(CN5CCOCC5)cc4)o3)CC2)nc1
InChIInChI=1S/C25H30N6O4/c32-24(28-33)21-15-26-25(27-16-21)31-9-7-29(8-10-31)18-22-5-6-23(35-22)20-3-1-19(2-4-20)17-30-11-13-34-14-12-30/h1-6,15-16,33H,7-14,17-18H2,(H,28,32)
InChIKeyRNSVGRSSOGNOGL-UHFFFAOYSA-N
MW478.55 g/mol
LogP2.01
Rot. Bonds7

About N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide

N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide (PubChem CID 10310972) has the molecular formula C25H30N6O4 and a molecular weight of 478.55 g/mol. Its IUPAC name is N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide
PubChem CID10310972
Molecular FormulaC25H30N6O4
Molecular Weight478.55 g/mol
Exact Mass478.23
IUPAC NameN-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide
SMILESO=C(NO)c1cnc(N2CCN(Cc3ccc(-c4ccc(CN5CCOCC5)cc4)o3)CC2)nc1
InChIInChI=1S/C25H30N6O4/c32-24(28-33)21-15-26-25(27-16-21)31-9-7-29(8-10-31)18-22-5-6-23(35-22)20-3-1-19(2-4-20)17-30-11-13-34-14-12-30/h1-6,15-16,33H,7-14,17-18H2,(H,28,32)
InChIKeyRNSVGRSSOGNOGL-UHFFFAOYSA-N
XLogP2.01
TPSA107.20 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500478.55
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-hydroxy-2-[4-[4-[4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]phenyl]phenyl]sulfonylpiperazin-1-yl]pyrimidine-5-carboxamide
CID 58845103
5-(4-bromophenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide
CID 1316619
N-hydroxy-2-[7-(morpholin-4-ylmethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]pyrimidine-5-carboxamide
CID 11996041
N-hydroxy-2-[4-[4-[2-(morpholin-4-ylmethyl)thiophen-3-yl]phenyl]sulfonylpiperazin-1-yl]pyrimidine-5-carboxamide
CID 58845150
N-hydroxy-2-[4-[4-[5-(morpholin-4-ylmethyl)-2,3-dihydrothiophen-4-yl]phenyl]sulfonylpiperazin-1-yl]pyrimidine-5-carboxamide
CID 88584489
4-[[5-(3,4-dichlorophenyl)furan-2-yl]methyl]morpholine
CID 142747429
N-hydroxy-4-[[4-[4-(morpholin-4-ylmethyl)phenyl]triazol-1-yl]methyl]benzamide
CID 50991200
2-[4-[(E)-4-(4-chlorophenyl)-1-morpholin-4-ylbut-3-en-2-yl]piperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide
CID 58896200
4-[(5-quinazolin-6-ylfuran-2-yl)methyl]morpholine
CID 141290610
4-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]morpholine
CID 155546801
N-[(2S,3R)-3-hydroxy-1-(hydroxyamino)-1-oxobutan-2-yl]-4-[5-[4-(morpholin-4-ylmethyl)phenyl]-1,3-oxazol-2-yl]benzamide
CID 59417053
5-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxylic acid
CID 56716837

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide?
The IUPAC name of N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide (CID 10310972) is N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide.
What is the SMILES notation for N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide?
The canonical SMILES for N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide is O=C(NO)c1cnc(N2CCN(Cc3ccc(-c4ccc(CN5CCOCC5)cc4)o3)CC2)nc1.
What is the InChIKey of N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide?
The InChIKey is RNSVGRSSOGNOGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N6O4/c32-24(28-33)21-15-26-25(27-16-21)31-9-7-29(8-10-31)18-22-5-6-23(35-22)20-3-1-19(2-4-20)17-30-11-13-34-14-12-30/h1-6,15-16,33H,7-14,17-18H2,(H,28,32).
What are the key properties of N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide?
N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide has a molecular weight of 478.55 g/mol, XLogP of 2.01, 7 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[4-[[5-[4-(morpholin-4-ylmethyl)phenyl]furan-2-yl]methyl]piperazin-1-yl]pyrimidine-5-carboxamide is sourced from PubChem (CID 10310972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).