N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide

C15H26N4O — CID 131898293

IUPACN-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide
SMILESCC(=O)NC(C)(C)CC(C)N1CCc2n[nH]c(C)c2C1
InChIInChI=1S/C15H26N4O/c1-10(8-15(4,5)16-12(3)20)19-7-6-14-13(9-19)11(2)17-18-14/h10H,6-9H2,1-5H3,(H,16,20)(H,17,18)
InChIKeyPZKOBXRVOAPQDP-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.77
Rot. Bonds4

About N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide

N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide (PubChem CID 131898293) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide.

Molecular Properties

Compound NameN-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide
PubChem CID131898293
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide
SMILESCC(=O)NC(C)(C)CC(C)N1CCc2n[nH]c(C)c2C1
InChIInChI=1S/C15H26N4O/c1-10(8-15(4,5)16-12(3)20)19-7-6-14-13(9-19)11(2)17-18-14/h10H,6-9H2,1-5H3,(H,16,20)(H,17,18)
InChIKeyPZKOBXRVOAPQDP-UHFFFAOYSA-N
XLogP1.77
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide?
The IUPAC name of N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide (CID 131898293) is N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide.
What is the SMILES notation for N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide?
The canonical SMILES for N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide is CC(=O)NC(C)(C)CC(C)N1CCc2n[nH]c(C)c2C1.
What is the InChIKey of N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide?
The InChIKey is PZKOBXRVOAPQDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-10(8-15(4,5)16-12(3)20)19-7-6-14-13(9-19)11(2)17-18-14/h10H,6-9H2,1-5H3,(H,16,20)(H,17,18).
What are the key properties of N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide?
N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide has a molecular weight of 278.40 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-4-(3-methyl-2,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)pentan-2-yl]acetamide is sourced from PubChem (CID 131898293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).