N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine

C11H15N3O2 — CID 115711122

IUPACN-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine
SMILESCOCc1ccc(CNc2ccn(C)n2)o1
InChIInChI=1S/C11H15N3O2/c1-14-6-5-11(13-14)12-7-9-3-4-10(16-9)8-15-2/h3-6H,7-8H2,1-2H3,(H,12,13)
InChIKeyMGKFBCCEJHWPLC-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.77
Rot. Bonds5

About N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine

N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine (PubChem CID 115711122) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine.

Molecular Properties

Compound NameN-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine
PubChem CID115711122
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine
SMILESCOCc1ccc(CNc2ccn(C)n2)o1
InChIInChI=1S/C11H15N3O2/c1-14-6-5-11(13-14)12-7-9-3-4-10(16-9)8-15-2/h3-6H,7-8H2,1-2H3,(H,12,13)
InChIKeyMGKFBCCEJHWPLC-UHFFFAOYSA-N
XLogP1.77
TPSA52.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[[(1-methylpyrazol-3-yl)amino]methyl]furan-2-carbonitrile
CID 115697836
1-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pyrazol-3-amine
CID 54921369
N-[[5-(methoxymethyl)furan-2-yl]methyl]pyridin-2-amine
CID 115735525
3-methyl-5-[[(1-methylpyrazol-3-yl)amino]methyl]furan-2-carboxylic acid
CID 103256805
N-[2-(2-methoxyethoxy)ethyl]-1-methylpyrazol-3-amine
CID 79778277
N-[(2-ethylpyrazol-3-yl)methyl]-1-methylpyrazol-3-amine
CID 19626399
N-[(5-fluorothiophen-2-yl)methyl]-1-methylpyrazol-3-amine;hydrochloride
CID 126964997
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-methylpyrazol-3-amine
CID 79778271
N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-methylpyrazol-3-amine;hydrochloride
CID 126963985
1-methyl-N-[(2-propan-2-ylpyrazol-3-yl)methyl]pyrazol-3-amine
CID 122167062
1-methyl-N-[[2,4,6-trimethyl-3-[[(1-methylpyrazol-3-yl)amino]methyl]-5-[[2,4,6-trimethyl-3,5-bis[[(1-methylpyrazol-3-yl)amino]methyl]phenyl]methyl]phenyl]methyl]pyrazol-3-amine
CID 122206251
N-[(4-iodophenyl)methyl]-1-methylpyrazol-3-amine
CID 79778850

Frequently Asked Questions

What is the IUPAC name of N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine?
The IUPAC name of N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine (CID 115711122) is N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine.
What is the SMILES notation for N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine?
The canonical SMILES for N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine is COCc1ccc(CNc2ccn(C)n2)o1.
What is the InChIKey of N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine?
The InChIKey is MGKFBCCEJHWPLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-14-6-5-11(13-14)12-7-9-3-4-10(16-9)8-15-2/h3-6H,7-8H2,1-2H3,(H,12,13).
What are the key properties of N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine?
N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine has a molecular weight of 221.26 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrazol-3-amine is sourced from PubChem (CID 115711122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).