N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide

C15H24N4O — CID 19537083

IUPACN-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide
SMILESCc1ccn(C(C)C(=O)NC2CC3CCC(C2)N3C)n1
InChIInChI=1S/C15H24N4O/c1-10-6-7-19(17-10)11(2)15(20)16-12-8-13-4-5-14(9-12)18(13)3/h6-7,11-14H,4-5,8-9H2,1-3H3,(H,16,20)
InChIKeyJCMWTLYKUMNCMP-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.49
Rot. Bonds3

About N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide

N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide (PubChem CID 19537083) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide
PubChem CID19537083
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide
SMILESCc1ccn(C(C)C(=O)NC2CC3CCC(C2)N3C)n1
InChIInChI=1S/C15H24N4O/c1-10-6-7-19(17-10)11(2)15(20)16-12-8-13-4-5-14(9-12)18(13)3/h6-7,11-14H,4-5,8-9H2,1-3H3,(H,16,20)
InChIKeyJCMWTLYKUMNCMP-UHFFFAOYSA-N
XLogP1.49
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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N-(1-ethylpiperidin-4-yl)-2-[2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]acetamide
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8-methyl-N-[2-(3-methyl-1H-pyrazol-1-yl)ethyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide
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CID 91923159
1-[1-[(2-Methylpyrazol-3-yl)methyl]piperidin-4-yl]imidazolidin-2-one
CID 134790097
3-[1-[(2-methylpyrazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one
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N-(2-aminoethyl)-2-(5-methyl-1H-pyrazol-1-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide?
The IUPAC name of N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide (CID 19537083) is N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide.
What is the SMILES notation for N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide?
The canonical SMILES for N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide is Cc1ccn(C(C)C(=O)NC2CC3CCC(C2)N3C)n1.
What is the InChIKey of N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide?
The InChIKey is JCMWTLYKUMNCMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-10-6-7-19(17-10)11(2)15(20)16-12-8-13-4-5-14(9-12)18(13)3/h6-7,11-14H,4-5,8-9H2,1-3H3,(H,16,20).
What are the key properties of N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide?
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide has a molecular weight of 276.38 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(3-methylpyrazol-1-yl)propanamide is sourced from PubChem (CID 19537083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).