(2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine

C9H16N4 — CID 105439071

IUPAC(2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine
SMILESCCn1nc2c(c1CN)CNCC2
InChIInChI=1S/C9H16N4/c1-2-13-9(5-10)7-6-11-4-3-8(7)12-13/h11H,2-6,10H2,1H3
InChIKeyRTKHGFGBUPVBKQ-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.01
Rot. Bonds2

About (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine

(2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine (PubChem CID 105439071) has the molecular formula C9H16N4 and a molecular weight of 180.25 g/mol. Its IUPAC name is (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine.

Molecular Properties

Compound Name(2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine
PubChem CID105439071
Molecular FormulaC9H16N4
Molecular Weight180.25 g/mol
Exact Mass180.14
IUPAC Name(2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine
SMILESCCn1nc2c(c1CN)CNCC2
InChIInChI=1S/C9H16N4/c1-2-13-9(5-10)7-6-11-4-3-8(7)12-13/h11H,2-6,10H2,1H3
InChIKeyRTKHGFGBUPVBKQ-UHFFFAOYSA-N
XLogP0.01
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine
CID 112711119
2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 105448944
(2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol
CID 105439524
1,3-diethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 84647059
3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 105487454
3-ethyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 83670995
N-ethyl-2-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
CID 84657575
3-(chloromethyl)-2-ethyl-4,5,6,7-tetrahydroindazole
CID 121214384
[2-(2-methylpropyl)-4,5,6,7-tetrahydroindazol-3-yl]methanamine
CID 105461216
(2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine
CID 105459638
4-(3-ethyltriazol-4-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 114213335
methyl 1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate
CID 105462928

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine?
The IUPAC name of (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine (CID 105439071) is (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine.
What is the SMILES notation for (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine?
The canonical SMILES for (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine is CCn1nc2c(c1CN)CNCC2.
What is the InChIKey of (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine?
The InChIKey is RTKHGFGBUPVBKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-2-13-9(5-10)7-6-11-4-3-8(7)12-13/h11H,2-6,10H2,1H3.
What are the key properties of (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine?
(2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine has a molecular weight of 180.25 g/mol, XLogP of 0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine is sourced from PubChem (CID 105439071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).