N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine

C10H13N3O — CID 19626581

IUPACN-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine
SMILESCn1nccc1CNCc1ccco1
InChIInChI=1S/C10H13N3O/c1-13-9(4-5-12-13)7-11-8-10-3-2-6-14-10/h2-6,11H,7-8H2,1H3
InChIKeyMOXLGFYNBKDMDW-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.30
Rot. Bonds4

About N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine

N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine (PubChem CID 19626581) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine
PubChem CID19626581
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC NameN-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine
SMILESCn1nccc1CNCc1ccco1
InChIInChI=1S/C10H13N3O/c1-13-9(4-5-12-13)7-11-8-10-3-2-6-14-10/h2-6,11H,7-8H2,1H3
InChIKeyMOXLGFYNBKDMDW-UHFFFAOYSA-N
XLogP1.30
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)-1-(2-propan-2-ylpyrazol-3-yl)methanamine;hydrochloride
CID 126967579
N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-4-ylmethanamine
CID 19626583
1-(2-methylpyrazol-3-yl)-N-(thiophen-2-ylmethyl)methanamine
CID 19626588
1-(4-methylphenyl)-N-[(2-methylpyrazol-3-yl)methyl]methanamine
CID 19618976
N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-3-ylmethanamine
CID 19626584
1-[2-[(dimethylamino)methyl]phenyl]-N-[(2-methylpyrazol-3-yl)methyl]methanamine
CID 43663267
2,2,2-trifluoro-N-[(2-methylpyrazol-3-yl)methyl]ethanamine
CID 43663111
1-(3-fluorophenyl)-N-[(2-methylpyrazol-3-yl)methyl]methanamine
CID 19625004
methyl 5-[[(2-methylpyrazol-3-yl)methylamino]methyl]furan-2-carboxylate
CID 63302632
3-methyl-N-[(2-methylpyrazol-3-yl)methyl]butan-1-amine
CID 43435289
1-cyclopropyl-N-[(2-methylpyrazol-3-yl)methyl]methanamine
CID 43663124
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-1-(2-methylpyrazol-3-yl)methanamine
CID 63302222

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine?
The IUPAC name of N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine (CID 19626581) is N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine.
What is the SMILES notation for N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine?
The canonical SMILES for N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine is Cn1nccc1CNCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine?
The InChIKey is MOXLGFYNBKDMDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-13-9(4-5-12-13)7-11-8-10-3-2-6-14-10/h2-6,11H,7-8H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine?
N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine has a molecular weight of 191.23 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)methanamine is sourced from PubChem (CID 19626581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).