(6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine

C12H19N3 — CID 137067834

IUPAC(6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine
SMILESCC(C)n1ncc2c1N[C@H](C1CC1)CC2
InChIInChI=1S/C12H19N3/c1-8(2)15-12-10(7-13-15)5-6-11(14-12)9-3-4-9/h7-9,11,14H,3-6H2,1-2H3/t11-/m0/s1
InChIKeyDZGGOWSVWBYXKG-NSHDSACASA-N
MW205.31 g/mol
LogP2.60
Rot. Bonds2

About (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine

(6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine (PubChem CID 137067834) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name(6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine
PubChem CID137067834
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name(6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine
SMILESCC(C)n1ncc2c1N[C@H](C1CC1)CC2
InChIInChI=1S/C12H19N3/c1-8(2)15-12-10(7-13-15)5-6-11(14-12)9-3-4-9/h7-9,11,14H,3-6H2,1-2H3/t11-/m0/s1
InChIKeyDZGGOWSVWBYXKG-NSHDSACASA-N
XLogP2.60
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine with MolForge

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Launch Full Analysis

Related Compounds

(6R)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine
CID 137067833
(6S)-6-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine
CID 137067823
(1S,9R)-4-propan-2-yl-2,4,5-triazatricyclo[7.3.0.03,7]dodeca-3(7),5-diene
CID 137067842
(1R,9S)-4-propan-2-yl-2,4,5-triazatricyclo[7.3.0.03,7]dodeca-3(7),5-diene
CID 137067843
(6S)-1-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-6-carboxylic acid
CID 129375486
6-methyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine-4-carboxylic acid
CID 137027793
1-propan-2-yl-5,6-dihydro-4H-thiopyrano[3,2-d]pyrazole 7-oxide
CID 122696837
2-(2-propan-2-ylpyrazol-3-yl)-1,2,3,4-tetrahydroquinoline
CID 114197792
(4S)-1-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine
CID 97181754
8-bromo-2-cyclopropyl-6-propan-2-yl-1,2,3,4-tetrahydroquinoline
CID 132589455
4-cyclopropyl-1,5-di(propan-2-yl)pyrazole
CID 168800092
N-[2-bicyclo[2.2.1]heptanyl-(4-bromo-1-propan-2-ylpyrazol-5-yl)methyl]ethanamine
CID 114660353

Frequently Asked Questions

What is the IUPAC name of (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine?
The IUPAC name of (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine (CID 137067834) is (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine.
What is the SMILES notation for (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine?
The canonical SMILES for (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine is CC(C)n1ncc2c1N[C@H](C1CC1)CC2.
What is the InChIKey of (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine?
The InChIKey is DZGGOWSVWBYXKG-NSHDSACASA-N. The full InChI is InChI=1S/C12H19N3/c1-8(2)15-12-10(7-13-15)5-6-11(14-12)9-3-4-9/h7-9,11,14H,3-6H2,1-2H3/t11-/m0/s1.
What are the key properties of (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine?
(6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine has a molecular weight of 205.31 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-cyclopropyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine is sourced from PubChem (CID 137067834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).