N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride

C10H14ClN3O2 — CID 126966130

IUPACN-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride
SMILESCOc1nn(C)cc1NCc1ccco1.Cl
InChIInChI=1S/C10H13N3O2.ClH/c1-13-7-9(10(12-13)14-2)11-6-8-4-3-5-15-8;/h3-5,7,11H,6H2,1-2H3;1H
InChIKeyNFKBHVWXJWXVIG-UHFFFAOYSA-N
MW243.69 g/mol
LogP2.06
Rot. Bonds4

About N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride

N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride (PubChem CID 126966130) has the molecular formula C10H14ClN3O2 and a molecular weight of 243.69 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride
PubChem CID126966130
Molecular FormulaC10H14ClN3O2
Molecular Weight243.69 g/mol
Exact Mass243.08
IUPAC NameN-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride
SMILESCOc1nn(C)cc1NCc1ccco1.Cl
InChIInChI=1S/C10H13N3O2.ClH/c1-13-7-9(10(12-13)14-2)11-6-8-4-3-5-15-8;/h3-5,7,11H,6H2,1-2H3;1H
InChIKeyNFKBHVWXJWXVIG-UHFFFAOYSA-N
XLogP2.06
TPSA52.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.69
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[4-(dimethylamino)phenyl]methyl]-3-methoxy-1-methylpyrazol-4-amine;dihydrochloride
CID 126965086
2-chloro-N-(furan-2-ylmethyl)-8-methoxy-1,7-naphthyridin-4-amine
CID 174270619
2-chloro-N-(furan-2-ylmethyl)pyridin-3-amine
CID 43689872
N-[(1,5-dimethylpyrazol-4-yl)methyl]-3-methoxy-1-methylpyrazol-4-amine;hydrochloride
CID 126967836
N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-1-(furan-2-yl)methanamine
CID 43552093
2-chloro-N-(furan-2-ylmethyl)-4-methoxyaniline
CID 115877187
1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine
CID 19626815
3-methoxy-1-methyl-N-[[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]methyl]pyrazol-4-amine;hydrochloride
CID 126964248
3-methoxy-1-methyl-N-[[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methyl]pyrazol-4-amine
CID 122167934
N-(furan-2-ylmethyl)-2-methoxy-5-methylaniline
CID 23879682
N-(furan-2-ylmethyl)-5-methoxy-2-methylaniline
CID 115743618
3-bromo-5-chloro-N-(furan-2-ylmethyl)-2-methoxyaniline
CID 43689281

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride?
The IUPAC name of N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride (CID 126966130) is N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride.
What is the SMILES notation for N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride?
The canonical SMILES for N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride is COc1nn(C)cc1NCc1ccco1.Cl.
What is the InChIKey of N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride?
The InChIKey is NFKBHVWXJWXVIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2.ClH/c1-13-7-9(10(12-13)14-2)11-6-8-4-3-5-15-8;/h3-5,7,11H,6H2,1-2H3;1H.
What are the key properties of N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride?
N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride has a molecular weight of 243.69 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-3-methoxy-1-methylpyrazol-4-amine;hydrochloride is sourced from PubChem (CID 126966130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).