1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine

C14H19N3O2 — CID 43728942

IUPAC1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine
SMILESCOCCn1cc(NCc2cccc(OC)c2)cn1
InChIInChI=1S/C14H19N3O2/c1-18-7-6-17-11-13(10-16-17)15-9-12-4-3-5-14(8-12)19-2/h3-5,8,10-11,15H,6-7,9H2,1-2H3
InChIKeyDDZZNQXDAPUKBI-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.15
Rot. Bonds7

About 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine

1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine (PubChem CID 43728942) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine
PubChem CID43728942
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine
SMILESCOCCn1cc(NCc2cccc(OC)c2)cn1
InChIInChI=1S/C14H19N3O2/c1-18-7-6-17-11-13(10-16-17)15-9-12-4-3-5-14(8-12)19-2/h3-5,8,10-11,15H,6-7,9H2,1-2H3
InChIKeyDDZZNQXDAPUKBI-UHFFFAOYSA-N
XLogP2.15
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3,4-dimethylphenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine
CID 43787752
N-[(3-chloro-4-methoxyphenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine
CID 65021511
1-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazol-4-amine
CID 43728903
1-(2-methoxyethyl)-N-[(6-methoxy-2-pyridinyl)methyl]pyrazol-4-amine
CID 103347582
2-[4-[(3,5-dimethoxyphenyl)methylamino]pyrazol-1-yl]ethanol
CID 110928974
1-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)pyrazol-4-amine
CID 43728977
N-ethyl-1-(2-methoxyethyl)pyrazol-4-amine
CID 43729152
N-[(5-bromo-2-methoxyphenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine
CID 43729032
4-(2-methoxyethoxy)-N-[(3-methoxyphenyl)methyl]aniline
CID 43734134
2-[4-[(4-methoxyphenyl)methylamino]pyrazol-1-yl]ethanol;hydrochloride
CID 126965409
1-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]pyrazol-4-amine
CID 81312279
1-(2-methoxyethyl)-N-[[2-(trifluoromethyl)phenyl]methyl]pyrazol-4-amine
CID 43728941

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine?
The IUPAC name of 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine (CID 43728942) is 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine?
The canonical SMILES for 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine is COCCn1cc(NCc2cccc(OC)c2)cn1.
What is the InChIKey of 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine?
The InChIKey is DDZZNQXDAPUKBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-18-7-6-17-11-13(10-16-17)15-9-12-4-3-5-14(8-12)19-2/h3-5,8,10-11,15H,6-7,9H2,1-2H3.
What are the key properties of 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine?
1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine has a molecular weight of 261.32 g/mol, XLogP of 2.15, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]pyrazol-4-amine is sourced from PubChem (CID 43728942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).