3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide

C15H20N4O — CID 122568703

IUPAC3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide
SMILESCc1cccc(C(C)NC(=O)CCc2ccnn2C)n1
InChIInChI=1S/C15H20N4O/c1-11-5-4-6-14(17-11)12(2)18-15(20)8-7-13-9-10-16-19(13)3/h4-6,9-10,12H,7-8H2,1-3H3,(H,18,20)
InChIKeyIXPSWSITFBMNRB-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.93
Rot. Bonds5

About 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide

3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide (PubChem CID 122568703) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide.

Molecular Properties

Compound Name3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide
PubChem CID122568703
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide
SMILESCc1cccc(C(C)NC(=O)CCc2ccnn2C)n1
InChIInChI=1S/C15H20N4O/c1-11-5-4-6-14(17-11)12(2)18-15(20)8-7-13-9-10-16-19(13)3/h4-6,9-10,12H,7-8H2,1-3H3,(H,18,20)
InChIKeyIXPSWSITFBMNRB-UHFFFAOYSA-N
XLogP1.93
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;N-[1-(6-methyl-2-pyridinyl)ethyl]acetamide
CID 177366227
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2-cyclopropyl-2-[3-(2-methylpyrazol-3-yl)propanoylamino]acetic acid
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N-[(R)-(4-methylphenyl)-thiophen-2-ylmethyl]-3-(2-methylpyrazol-3-yl)propanamide
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CID 103000916
N-[[4-(aminomethyl)phenyl]methyl]-3-(2-methylpyrazol-3-yl)propanamide
CID 74247536
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(2-methylpyrazol-3-yl)propanamide
CID 124618083
1-(2-methylpyrazol-3-yl)-4-methylsulfonylpentan-3-one
CID 103024265
1-[(2-methylpyrazol-3-yl)methyl]-3-(6-methyl-2-pyridinyl)urea
CID 75507942
4-ethyl-1-(2-methylpyrazol-3-yl)hexan-3-one
CID 103024188
1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-one
CID 103007384
1-[2-(2-methylpyrazol-3-yl)ethyl]-3-propan-2-ylurea
CID 104693386

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide?
The IUPAC name of 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide (CID 122568703) is 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide.
What is the SMILES notation for 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide?
The canonical SMILES for 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide is Cc1cccc(C(C)NC(=O)CCc2ccnn2C)n1.
What is the InChIKey of 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide?
The InChIKey is IXPSWSITFBMNRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-11-5-4-6-14(17-11)12(2)18-15(20)8-7-13-9-10-16-19(13)3/h4-6,9-10,12H,7-8H2,1-3H3,(H,18,20).
What are the key properties of 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide?
3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide has a molecular weight of 272.35 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpyrazol-3-yl)-N-[1-(6-methyl-2-pyridinyl)ethyl]propanamide is sourced from PubChem (CID 122568703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).