3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine

C11H15N5 — CID 96610505

IUPAC3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine
SMILESCc1nc2c(c(N)nn2C)c2c1CCNC2
InChIInChI=1S/C11H15N5/c1-6-7-3-4-13-5-8(7)9-10(12)15-16(2)11(9)14-6/h13H,3-5H2,1-2H3,(H2,12,15)
InChIKeyLFSQHMADHWAKFS-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.50
Rot. Bonds

About 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine

3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine (PubChem CID 96610505) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine.

Molecular Properties

Compound Name3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine
PubChem CID96610505
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine
SMILESCc1nc2c(c(N)nn2C)c2c1CCNC2
InChIInChI=1S/C11H15N5/c1-6-7-3-4-13-5-8(7)9-10(12)15-16(2)11(9)14-6/h13H,3-5H2,1-2H3,(H2,12,15)
InChIKeyLFSQHMADHWAKFS-UHFFFAOYSA-N
XLogP0.50
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5,8-dimethyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1,3,6,8-tetraen-3-amine
CID 96619332
4-methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine
CID 112703747
1,3-dimethyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
CID 75465061
1,3-dimethyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
CID 177024453
1,4,6-trimethyl-5-nitropyrazolo[3,4-b]pyridin-3-amine
CID 5299649
2-methyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine-3-carbonitrile
CID 105431907
6-cyclopropyl-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
CID 175246786
2-amino-4-(1,5-dimethylindol-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile
CID 56908852
2-(2-methoxypropyl)-4-methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 114742173
(1-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanol;dihydrochloride
CID 50944322
4-methyl-2-(2-methylcyclopropyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 114742289
2-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine
CID 117101029

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine?
The IUPAC name of 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine (CID 96610505) is 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine.
What is the SMILES notation for 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine?
The canonical SMILES for 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine is Cc1nc2c(c(N)nn2C)c2c1CCNC2.
What is the InChIKey of 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine?
The InChIKey is LFSQHMADHWAKFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-6-7-3-4-13-5-8(7)9-10(12)15-16(2)11(9)14-6/h13H,3-5H2,1-2H3,(H2,12,15).
What are the key properties of 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine?
3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine has a molecular weight of 217.28 g/mol, XLogP of 0.50, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c][2,6]naphthyridin-1-amine is sourced from PubChem (CID 96610505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).