5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine

C16H22ClN5 — CID 71878475

IUPAC5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
SMILESCc1nn(C)c(Cl)c1CN1CCc2c(nc(C3CC3)n2C)C1
InChIInChI=1S/C16H22ClN5/c1-10-12(15(17)21(3)19-10)8-22-7-6-14-13(9-22)18-16(20(14)2)11-4-5-11/h11H,4-9H2,1-3H3
InChIKeyUOPKYCLWHUBGGY-UHFFFAOYSA-N
MW319.84 g/mol
LogP2.55
Rot. Bonds3

About 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine

5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine (PubChem CID 71878475) has the molecular formula C16H22ClN5 and a molecular weight of 319.84 g/mol. Its IUPAC name is 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
PubChem CID71878475
Molecular FormulaC16H22ClN5
Molecular Weight319.84 g/mol
Exact Mass319.16
IUPAC Name5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
SMILESCc1nn(C)c(Cl)c1CN1CCc2c(nc(C3CC3)n2C)C1
InChIInChI=1S/C16H22ClN5/c1-10-12(15(17)21(3)19-10)8-22-7-6-14-13(9-22)18-16(20(14)2)11-4-5-11/h11H,4-9H2,1-3H3
InChIKeyUOPKYCLWHUBGGY-UHFFFAOYSA-N
XLogP2.55
TPSA38.88 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.84
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]-4,5-dimethyl-1,3-oxazole
CID 71932744
5-chloro-1,3-dimethyl-4-[(3-methylpyrrolidin-1-yl)methyl]pyrazole
CID 61224422
1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-4,4-dimethylpiperidine
CID 55157463
1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-4-methyl-1,4-diazepane
CID 54918224
5-chloro-4-[(3-ethylpyrrolidin-1-yl)methyl]-1,3-dimethylpyrazole
CID 115688533
2-cyclopropyl-1-methyl-5-(2-pyridin-2-ylethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 71932513
1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]piperazine
CID 43162347
2-cyclopropyl-1-methyl-5-[2-[(R)-phenylsulfinyl]ethyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 97009721
4-chloro-1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-3-methylpiperidine
CID 114682232
2-[1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]piperidin-3-yl]ethanol
CID 62356478
6-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-2-thione
CID 24909547
1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]piperidine-3-carboxamide
CID 54920320

Frequently Asked Questions

What is the IUPAC name of 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The IUPAC name of 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine (CID 71878475) is 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The canonical SMILES for 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine is Cc1nn(C)c(Cl)c1CN1CCc2c(nc(C3CC3)n2C)C1.
What is the InChIKey of 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The InChIKey is UOPKYCLWHUBGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClN5/c1-10-12(15(17)21(3)19-10)8-22-7-6-14-13(9-22)18-16(20(14)2)11-4-5-11/h11H,4-9H2,1-3H3.
What are the key properties of 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine has a molecular weight of 319.84 g/mol, XLogP of 2.55, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 71878475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).