N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide

C15H26N4O2 — CID 83034554

IUPACN-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide
SMILESCOCCn1cc(NC(=O)C(C)(C)C2CCCNC2)cn1
InChIInChI=1S/C15H26N4O2/c1-15(2,12-5-4-6-16-9-12)14(20)18-13-10-17-19(11-13)7-8-21-3/h10-12,16H,4-9H2,1-3H3,(H,18,20)
InChIKeyVTUTYHHFELOPGP-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.49
Rot. Bonds6

About N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide

N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide (PubChem CID 83034554) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide.

Molecular Properties

Compound NameN-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide
PubChem CID83034554
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC NameN-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide
SMILESCOCCn1cc(NC(=O)C(C)(C)C2CCCNC2)cn1
InChIInChI=1S/C15H26N4O2/c1-15(2,12-5-4-6-16-9-12)14(20)18-13-10-17-19(11-13)7-8-21-3/h10-12,16H,4-9H2,1-3H3,(H,18,20)
InChIKeyVTUTYHHFELOPGP-UHFFFAOYSA-N
XLogP1.49
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide?
The IUPAC name of N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide (CID 83034554) is N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide.
What is the SMILES notation for N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide?
The canonical SMILES for N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide is COCCn1cc(NC(=O)C(C)(C)C2CCCNC2)cn1.
What is the InChIKey of N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide?
The InChIKey is VTUTYHHFELOPGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2/c1-15(2,12-5-4-6-16-9-12)14(20)18-13-10-17-19(11-13)7-8-21-3/h10-12,16H,4-9H2,1-3H3,(H,18,20).
What are the key properties of N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide?
N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide has a molecular weight of 294.40 g/mol, XLogP of 1.49, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyethyl)pyrazol-4-yl]-2-methyl-2-piperidin-3-ylpropanamide is sourced from PubChem (CID 83034554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).