N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide

C19H25N5O2 — CID 91839582

IUPACN-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide
SMILESCCc1n[nH]c2c1CN(CC(=O)NCc1ccc(NC(C)=O)cc1)CC2
InChIInChI=1S/C19H25N5O2/c1-3-17-16-11-24(9-8-18(16)23-22-17)12-19(26)20-10-14-4-6-15(7-5-14)21-13(2)25/h4-7H,3,8-12H2,1-2H3,(H,20,26)(H,21,25)(H,22,23)
InChIKeyHRRQHFHZGZAVKQ-UHFFFAOYSA-N
MW355.44 g/mol
LogP1.61
Rot. Bonds6

About N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide

N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide (PubChem CID 91839582) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide.

Molecular Properties

Compound NameN-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide
PubChem CID91839582
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide
SMILESCCc1n[nH]c2c1CN(CC(=O)NCc1ccc(NC(C)=O)cc1)CC2
InChIInChI=1S/C19H25N5O2/c1-3-17-16-11-24(9-8-18(16)23-22-17)12-19(26)20-10-14-4-6-15(7-5-14)21-13(2)25/h4-7H,3,8-12H2,1-2H3,(H,20,26)(H,21,25)(H,22,23)
InChIKeyHRRQHFHZGZAVKQ-UHFFFAOYSA-N
XLogP1.61
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide with MolForge

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Related Compounds

N-[(4-acetamidophenyl)methyl]-2-[4-(1H-1,2,4-triazol-5-yl)piperazin-1-yl]acetamide
CID 91843310
N-[4-[[3-(2-fluorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]methyl]phenyl]acetamide
CID 42517587
N-[(4-acetamidophenyl)methyl]-2-[(3S)-3-(5-methyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]acetamide
CID 124757287
N-[(4-acetamidophenyl)methyl]-2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide
CID 18154182
3-ethyl-5-(methoxymethyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 118493373
N-[(4-acetamidophenyl)methyl]-2-[(5R)-5-hydroxy-1-oxa-9-azaspiro[5.5]undecan-9-yl]acetamide
CID 124754716
N-[(4-acetamidophenyl)methyl]-2-methoxyacetamide
CID 29327648
N-[(4-fluorophenyl)methyl]-2-(1-methyl-3-oxo-2,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-6-yl)acetamide
CID 136563013
5-tert-butyl-4-[(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)methyl]furan-2-carboxamide
CID 91837708
N-[2-(3-naphthalen-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethyl]acetamide
CID 56753668
2-(4-acetylpiperazin-1-yl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 8904372
N-[(4-acetamidophenyl)methyl]-2-[(3R)-3-(3-methylphenyl)piperidin-1-yl]acetamide
CID 124846288

Frequently Asked Questions

What is the IUPAC name of N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide?
The IUPAC name of N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide (CID 91839582) is N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide.
What is the SMILES notation for N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide?
The canonical SMILES for N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide is CCc1n[nH]c2c1CN(CC(=O)NCc1ccc(NC(C)=O)cc1)CC2.
What is the InChIKey of N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide?
The InChIKey is HRRQHFHZGZAVKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-3-17-16-11-24(9-8-18(16)23-22-17)12-19(26)20-10-14-4-6-15(7-5-14)21-13(2)25/h4-7H,3,8-12H2,1-2H3,(H,20,26)(H,21,25)(H,22,23).
What are the key properties of N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide?
N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide has a molecular weight of 355.44 g/mol, XLogP of 1.61, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-acetamidophenyl)methyl]-2-(3-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)acetamide is sourced from PubChem (CID 91839582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).