1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine

C10H17N3O2 — CID 65352324

IUPAC1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
SMILESCNC(c1ccnn1C)C1COCCO1
InChIInChI=1S/C10H17N3O2/c1-11-10(8-3-4-12-13(8)2)9-7-14-5-6-15-9/h3-4,9-11H,5-7H2,1-2H3
InChIKeySGRUEFZWKUEBGQ-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.10
Rot. Bonds3

About 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine

1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine (PubChem CID 65352324) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine.

Molecular Properties

Compound Name1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
PubChem CID65352324
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
SMILESCNC(c1ccnn1C)C1COCCO1
InChIInChI=1S/C10H17N3O2/c1-11-10(8-3-4-12-13(8)2)9-7-14-5-6-15-9/h3-4,9-11H,5-7H2,1-2H3
InChIKeySGRUEFZWKUEBGQ-UHFFFAOYSA-N
XLogP0.10
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine
CID 65330463
1-(6-bicyclo[3.1.0]hexanyl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 115858379
[(2-methylpyrazol-3-yl)-(oxolan-3-yl)methyl]hydrazine
CID 105229276
3-[1,4-dioxan-2-yl(methylamino)methyl]pyridin-2-amine
CID 65352984
N-(1,4-dioxan-2-ylmethyl)-1-(2-methylpyrazol-3-yl)ethanamine
CID 106757647
[(4-methylmorpholin-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105244278
2-[4-bromo-5-[1,4-dioxan-2-yl(methylamino)methyl]pyrazol-1-yl]-N,N-dimethylethanamine
CID 105041124
N-methyl-1-(oxolan-2-yl)-1-(2-phenylpyrazol-3-yl)methanamine
CID 107330681
1-(5-chlorothiophen-2-yl)-1-(1,4-dioxan-2-yl)-N-methylmethanamine
CID 62798147
1-(4-butan-2-ylphenyl)-1-(1,4-dioxan-2-yl)-N-methylmethanamine
CID 62800261
N-methyl-1-(2-methylpyrazol-3-yl)-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105148778
1-(1,4-dioxan-2-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine
CID 105048056

Frequently Asked Questions

What is the IUPAC name of 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine?
The IUPAC name of 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine (CID 65352324) is 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine.
What is the SMILES notation for 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine?
The canonical SMILES for 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine is CNC(c1ccnn1C)C1COCCO1.
What is the InChIKey of 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine?
The InChIKey is SGRUEFZWKUEBGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-11-10(8-3-4-12-13(8)2)9-7-14-5-6-15-9/h3-4,9-11H,5-7H2,1-2H3.
What are the key properties of 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine?
1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine has a molecular weight of 211.26 g/mol, XLogP of 0.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine is sourced from PubChem (CID 65352324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).