3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine

C16H21N5 — CID 115573483

IUPAC3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine
SMILESCc1cc(C)n(CCCNCc2cn3ccccc3n2)n1
InChIInChI=1S/C16H21N5/c1-13-10-14(2)21(19-13)9-5-7-17-11-15-12-20-8-4-3-6-16(20)18-15/h3-4,6,8,10,12,17H,5,7,9,11H2,1-2H3
InChIKeyUMWWMWWUWJTTEN-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.33
Rot. Bonds6

About 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine

3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine (PubChem CID 115573483) has the molecular formula C16H21N5 and a molecular weight of 283.38 g/mol. Its IUPAC name is 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine
PubChem CID115573483
Molecular FormulaC16H21N5
Molecular Weight283.38 g/mol
Exact Mass283.18
IUPAC Name3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine
SMILESCc1cc(C)n(CCCNCc2cn3ccccc3n2)n1
InChIInChI=1S/C16H21N5/c1-13-10-14(2)21(19-13)9-5-7-17-11-15-12-20-8-4-3-6-16(20)18-15/h3-4,6,8,10,12,17H,5,7,9,11H2,1-2H3
InChIKeyUMWWMWWUWJTTEN-UHFFFAOYSA-N
XLogP2.33
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.33
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

4-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)butan-1-amine
CID 106844928
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-iodopentan-1-amine
CID 107320212
6-[[3-(3,5-dimethylpyrazol-1-yl)propylamino]methyl]pyridine-2-carboxylic acid
CID 106904990
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine
CID 60689918
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine
CID 114505443
3-cyclopropyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine
CID 115654278
3-(3,5-dimethylpyrazol-1-yl)-N-[(2-methoxyphenyl)methyl]propan-1-amine
CID 78804066
3-(3,5-dimethylpyrazol-1-yl)-N-(2-phenylethyl)propan-1-amine
CID 115572658
3-(3,5-dimethylpyrazol-1-yl)-N-(thiophen-2-ylmethyl)propan-1-amine
CID 78809935
1-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-methyl-3-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]guanidine
CID 111783819
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(6-methyl-3-pyridinyl)methanamine
CID 62996570
N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-3-(3,5-dimethylpyrazol-1-yl)propan-1-amine
CID 114536435

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine?
The IUPAC name of 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine (CID 115573483) is 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine.
What is the SMILES notation for 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine?
The canonical SMILES for 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine is Cc1cc(C)n(CCCNCc2cn3ccccc3n2)n1.
What is the InChIKey of 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine?
The InChIKey is UMWWMWWUWJTTEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5/c1-13-10-14(2)21(19-13)9-5-7-17-11-15-12-20-8-4-3-6-16(20)18-15/h3-4,6,8,10,12,17H,5,7,9,11H2,1-2H3.
What are the key properties of 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine?
3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine has a molecular weight of 283.38 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethylpyrazol-1-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine is sourced from PubChem (CID 115573483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).