5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine

C10H20N4O — CID 61102493

IUPAC5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine
SMILESCc1nn(C)c(OCCCN(C)C)c1N
InChIInChI=1S/C10H20N4O/c1-8-9(11)10(14(4)12-8)15-7-5-6-13(2)3/h5-7,11H2,1-4H3
InChIKeyWOWXROWLNXIATC-UHFFFAOYSA-N
MW212.30 g/mol
LogP0.64
Rot. Bonds5

About 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine

5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine (PubChem CID 61102493) has the molecular formula C10H20N4O and a molecular weight of 212.30 g/mol. Its IUPAC name is 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine.

Molecular Properties

Compound Name5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine
PubChem CID61102493
Molecular FormulaC10H20N4O
Molecular Weight212.30 g/mol
Exact Mass212.16
IUPAC Name5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine
SMILESCc1nn(C)c(OCCCN(C)C)c1N
InChIInChI=1S/C10H20N4O/c1-8-9(11)10(14(4)12-8)15-7-5-6-13(2)3/h5-7,11H2,1-4H3
InChIKeyWOWXROWLNXIATC-UHFFFAOYSA-N
XLogP0.64
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-[3-(dimethylamino)propoxy]-3-methyl-1-propan-2-ylpyrazol-4-amine
CID 66024839
5-hexoxy-1,3-dimethylpyrazol-4-amine
CID 43554474
5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazole-4-carboximidamide
CID 55242716
5-[3-(2-methoxyethoxy)propoxy]-1,3-dimethylpyrazol-4-amine
CID 103400910
5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine
CID 43554429
5-(cyclopropylmethoxy)-1,3-dimethylpyrazol-4-amine
CID 43554459
5-N-(3-methoxypropyl)-5-N,1,3-trimethylpyrazole-4,5-diamine
CID 62985720
5-[(3-bromophenyl)methoxy]-1,3-dimethylpyrazol-4-amine
CID 82828534
5-[2-(diethylamino)ethoxy]-1-methyl-3-propan-2-ylpyrazol-4-amine
CID 66011388
1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine
CID 66013084
3-[3-(dimethylamino)propoxy]-6-methylpyridin-2-amine
CID 114524613
5-hexoxy-1-methyl-3-propan-2-ylpyrazol-4-amine
CID 66011970

Frequently Asked Questions

What is the IUPAC name of 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine?
The IUPAC name of 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine (CID 61102493) is 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine.
What is the SMILES notation for 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine?
The canonical SMILES for 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine is Cc1nn(C)c(OCCCN(C)C)c1N.
What is the InChIKey of 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine?
The InChIKey is WOWXROWLNXIATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O/c1-8-9(11)10(14(4)12-8)15-7-5-6-13(2)3/h5-7,11H2,1-4H3.
What are the key properties of 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine?
5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine has a molecular weight of 212.30 g/mol, XLogP of 0.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine is sourced from PubChem (CID 61102493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).