6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine

C12H13ClN4 — CID 175943834

IUPAC6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine
SMILESCN1CC=C(n2ncc3cnc(Cl)cc32)CC1
InChIInChI=1S/C12H13ClN4/c1-16-4-2-10(3-5-16)17-11-6-12(13)14-7-9(11)8-15-17/h2,6-8H,3-5H2,1H3
InChIKeyJDSYAKPYEKYJCN-UHFFFAOYSA-N
MW248.72 g/mol
LogP2.26
Rot. Bonds1

About 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine

6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine (PubChem CID 175943834) has the molecular formula C12H13ClN4 and a molecular weight of 248.72 g/mol. Its IUPAC name is 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine
PubChem CID175943834
Molecular FormulaC12H13ClN4
Molecular Weight248.72 g/mol
Exact Mass248.08
IUPAC Name6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine
SMILESCN1CC=C(n2ncc3cnc(Cl)cc32)CC1
InChIInChI=1S/C12H13ClN4/c1-16-4-2-10(3-5-16)17-11-6-12(13)14-7-9(11)8-15-17/h2,6-8H,3-5H2,1H3
InChIKeyJDSYAKPYEKYJCN-UHFFFAOYSA-N
XLogP2.26
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.72
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine
CID 169489359
3-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine
CID 176550502
6-chloro-1-(oxan-4-yl)pyrazolo[4,3-c]pyridine
CID 166460362
1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)benzotriazole
CID 10822527
5-chloro-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyridine
CID 138668016
4-[6-(6-chloropyrazolo[4,3-c]pyridin-1-yl)-2-pyridinyl]diazepane-1-carboxylic acid
CID 90030574
tert-butyl N-[(3S)-1-[6-(6-chloropyrazolo[4,3-c]pyridin-1-yl)-2-pyridinyl]piperidin-3-yl]carbamate
CID 86707103
[5-(6-chloro-1-methylpyrrolo[3,2-c]pyridin-2-yl)-3-pyridinyl]methanol
CID 59578439
6-chloro-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridine
CID 177306536
7-chloro-3-iodo-1-methyl-1,6-naphthyridin-2-one
CID 102144847
5-chloro-1-propan-2-ylpyrazolo[3,4-c]pyridine
CID 176811583
CID 163252822
CID 163252822

Frequently Asked Questions

What is the IUPAC name of 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine?
The IUPAC name of 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine (CID 175943834) is 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine?
The canonical SMILES for 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine is CN1CC=C(n2ncc3cnc(Cl)cc32)CC1.
What is the InChIKey of 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine?
The InChIKey is JDSYAKPYEKYJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN4/c1-16-4-2-10(3-5-16)17-11-6-12(13)14-7-9(11)8-15-17/h2,6-8H,3-5H2,1H3.
What are the key properties of 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine?
6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine has a molecular weight of 248.72 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 175943834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).