6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine

C12H13ClN6 — CID 106105696

IUPAC6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
SMILESCn1ccc(CCn2c(N)nc3cc(Cl)cnc32)n1
InChIInChI=1S/C12H13ClN6/c1-18-4-2-9(17-18)3-5-19-11-10(16-12(19)14)6-8(13)7-15-11/h2,4,6-7H,3,5H2,1H3,(H2,14,16)
InChIKeyBQOXDGKAUIRQBT-UHFFFAOYSA-N
MW276.73 g/mol
LogP1.64
Rot. Bonds3

About 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine

6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine (PubChem CID 106105696) has the molecular formula C12H13ClN6 and a molecular weight of 276.73 g/mol. Its IUPAC name is 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
PubChem CID106105696
Molecular FormulaC12H13ClN6
Molecular Weight276.73 g/mol
Exact Mass276.09
IUPAC Name6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
SMILESCn1ccc(CCn2c(N)nc3cc(Cl)cnc32)n1
InChIInChI=1S/C12H13ClN6/c1-18-4-2-9(17-18)3-5-19-11-10(16-12(19)14)6-8(13)7-15-11/h2,4,6-7H,3,5H2,1H3,(H2,14,16)
InChIKeyBQOXDGKAUIRQBT-UHFFFAOYSA-N
XLogP1.64
TPSA74.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.73
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-methyl-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
CID 106105694
6-chloro-3-[2-(1,2,4-oxadiazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
CID 106406257
5-methoxy-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
CID 106105695
6-chloro-3-(2-methoxypropyl)imidazo[4,5-b]pyridin-2-amine
CID 102699389
6-chloro-3-[[1-(dimethylamino)cyclopentyl]methyl]imidazo[4,5-b]pyridin-2-amine
CID 83114633
6-chloro-3-(2-cyclopropylpropyl)imidazo[4,5-b]pyridin-2-amine
CID 113475644
3,5-dichloro-N-[2-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine
CID 114144034
6-bromo-3-[2-(1-methylpyrazol-3-yl)ethyl]-1H-imidazo[4,5-b]pyridine-2-thione
CID 106105632
6-chloro-3-(3-ethyl-1-methylpyrazol-4-yl)imidazo[4,5-b]pyridin-2-amine
CID 107463910
6-chloro-3-(1,2,4-oxadiazol-3-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 106406104
1-ethyl-3-methyl-6-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-d]pyrazol-5-amine
CID 106105680
3-[2-(4-methoxyphenyl)ethyl]-6-methylimidazo[4,5-b]pyridin-2-amine
CID 79279800

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine (CID 106105696) is 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine is Cn1ccc(CCn2c(N)nc3cc(Cl)cnc32)n1.
What is the InChIKey of 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
The InChIKey is BQOXDGKAUIRQBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN6/c1-18-4-2-9(17-18)3-5-19-11-10(16-12(19)14)6-8(13)7-15-11/h2,4,6-7H,3,5H2,1H3,(H2,14,16).
What are the key properties of 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine?
6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine has a molecular weight of 276.73 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 106105696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).