N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide

C10H10ClN3O2 — CID 19322761

IUPACN-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide
SMILESCn1ncc(Cl)c1CNC(=O)c1ccco1
InChIInChI=1S/C10H10ClN3O2/c1-14-8(7(11)5-13-14)6-12-10(15)9-3-2-4-16-9/h2-5H,6H2,1H3,(H,12,15)
InChIKeyDTTFWSCMSRXLDC-UHFFFAOYSA-N
MW239.66 g/mol
LogP1.60
Rot. Bonds3

About N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide

N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide (PubChem CID 19322761) has the molecular formula C10H10ClN3O2 and a molecular weight of 239.66 g/mol. Its IUPAC name is N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide
PubChem CID19322761
Molecular FormulaC10H10ClN3O2
Molecular Weight239.66 g/mol
Exact Mass239.05
IUPAC NameN-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide
SMILESCn1ncc(Cl)c1CNC(=O)c1ccco1
InChIInChI=1S/C10H10ClN3O2/c1-14-8(7(11)5-13-14)6-12-10(15)9-3-2-4-16-9/h2-5H,6H2,1H3,(H,12,15)
InChIKeyDTTFWSCMSRXLDC-UHFFFAOYSA-N
XLogP1.60
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.66
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dichloro-N-[(4-chloro-1-methylpyrazol-5-yl)methyl]benzamide
CID 19322901
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]furan-2-carboxamide
CID 19290411
N-[(4-chloro-1-methylpyrazol-5-yl)methyl]-4-[(4-chlorophenoxy)methyl]benzamide
CID 19322891
N-[(4-chloro-1-methylpyrazol-5-yl)methyl]-5-[(5-methyl-2-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 19322731
N-[(4-chloro-1-methylpyrazol-5-yl)methyl]-1,5-dimethyl-4-nitropyrazole-3-carboxamide
CID 19322734
N-[(4-chloro-1-methylpyrazol-5-yl)methyl]-4-[(4-nitropyrazol-1-yl)methyl]benzamide
CID 19322693
N-[(5-methyl-1H-pyrazol-4-yl)methyl]furan-2-carboxamide
CID 60767686
4-(furan-2-carbonylamino)-1-methylpyrazole-5-carboxylic acid
CID 19406055
N-[2-[(2-chloroacetyl)amino]ethyl]furan-2-carboxamide
CID 108571159
N-(1H-pyrrol-2-ylmethyl)furan-2-carboxamide
CID 110374911
N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide
CID 75357594
N-[2-[(3,4-dichlorobenzoyl)amino]ethyl]furan-2-carboxamide
CID 6490902

Frequently Asked Questions

What is the IUPAC name of N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide?
The IUPAC name of N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide (CID 19322761) is N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide?
The canonical SMILES for N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide is Cn1ncc(Cl)c1CNC(=O)c1ccco1.
What is the InChIKey of N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide?
The InChIKey is DTTFWSCMSRXLDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O2/c1-14-8(7(11)5-13-14)6-12-10(15)9-3-2-4-16-9/h2-5H,6H2,1H3,(H,12,15).
What are the key properties of N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide?
N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide has a molecular weight of 239.66 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chloro-1-methylpyrazol-5-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 19322761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).