N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide

C18H25N5O3 — CID 126426149

IUPACN-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
SMILESCCn1ncnc1[C@@H](NC(=O)c1coc(CN2CCOCC2)c1)C1CC1
InChIInChI=1S/C18H25N5O3/c1-2-23-17(19-12-20-23)16(13-3-4-13)21-18(24)14-9-15(26-11-14)10-22-5-7-25-8-6-22/h9,11-13,16H,2-8,10H2,1H3,(H,21,24)/t16-/m0/s1
InChIKeyFZAPJHADSNNAHT-INIZCTEOSA-N
MW359.43 g/mol
LogP1.60
Rot. Bonds7

About N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide

N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide (PubChem CID 126426149) has the molecular formula C18H25N5O3 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
PubChem CID126426149
Molecular FormulaC18H25N5O3
Molecular Weight359.43 g/mol
Exact Mass359.20
IUPAC NameN-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
SMILESCCn1ncnc1[C@@H](NC(=O)c1coc(CN2CCOCC2)c1)C1CC1
InChIInChI=1S/C18H25N5O3/c1-2-23-17(19-12-20-23)16(13-3-4-13)21-18(24)14-9-15(26-11-14)10-22-5-7-25-8-6-22/h9,11-13,16H,2-8,10H2,1H3,(H,21,24)/t16-/m0/s1
InChIKeyFZAPJHADSNNAHT-INIZCTEOSA-N
XLogP1.60
TPSA85.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide with MolForge

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Related Compounds

N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-2-ethyl-4-methyl-1,3-oxazole-5-carboxamide
CID 126446578
N-[(R)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]tetrazolo[1,5-a]pyridine-6-carboxamide
CID 126442842
N-[cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-6-(dimethylamino)pyridine-3-carboxamide
CID 118778831
5-(morpholin-4-ylmethyl)-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]furan-3-carboxamide
CID 97188780
N-[cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-2-methylsulfanylbenzamide
CID 91794119
N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-4-(2,4-dioxoimidazolidin-1-yl)benzamide
CID 125161407
5-(morpholin-4-ylmethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]furan-3-carboxamide
CID 97189860
N-[(R)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-4-(2,4-dioxoimidazolidin-1-yl)benzamide
CID 125161410
N-[(R)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-4-hydroxycyclohexane-1-carboxamide
CID 124753495
N-[cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 91828880
N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 118788788
N-[(1S)-2-(methylamino)-2-oxo-1-phenylethyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 125172950

Frequently Asked Questions

What is the IUPAC name of N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide?
The IUPAC name of N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide (CID 126426149) is N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide.
What is the SMILES notation for N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide?
The canonical SMILES for N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide is CCn1ncnc1[C@@H](NC(=O)c1coc(CN2CCOCC2)c1)C1CC1.
What is the InChIKey of N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide?
The InChIKey is FZAPJHADSNNAHT-INIZCTEOSA-N. The full InChI is InChI=1S/C18H25N5O3/c1-2-23-17(19-12-20-23)16(13-3-4-13)21-18(24)14-9-15(26-11-14)10-22-5-7-25-8-6-22/h9,11-13,16H,2-8,10H2,1H3,(H,21,24)/t16-/m0/s1.
What are the key properties of N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide?
N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide has a molecular weight of 359.43 g/mol, XLogP of 1.60, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(S)-cyclopropyl-(2-ethyl-1,2,4-triazol-3-yl)methyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide is sourced from PubChem (CID 126426149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).