N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine

C16H23N7 — CID 70751078

IUPACN,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCc1nc(N(C)CCCc2nccn2C)c2c(C)nn(C)c2n1
InChIInChI=1S/C16H23N7/c1-11-14-15(18-12(2)19-16(14)23(5)20-11)22(4)9-6-7-13-17-8-10-21(13)3/h8,10H,6-7,9H2,1-5H3
InChIKeyHRFVOMABWGDRSN-UHFFFAOYSA-N
MW313.41 g/mol
LogP1.78
Rot. Bonds5

About N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine

N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 70751078) has the molecular formula C16H23N7 and a molecular weight of 313.41 g/mol. Its IUPAC name is N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID70751078
Molecular FormulaC16H23N7
Molecular Weight313.41 g/mol
Exact Mass313.20
IUPAC NameN,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCc1nc(N(C)CCCc2nccn2C)c2c(C)nn(C)c2n1
InChIInChI=1S/C16H23N7/c1-11-14-15(18-12(2)19-16(14)23(5)20-11)22(4)9-6-7-13-17-8-10-21(13)3/h8,10H,6-7,9H2,1-5H3
InChIKeyHRFVOMABWGDRSN-UHFFFAOYSA-N
XLogP1.78
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.41
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine (CID 70751078) is N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine is Cc1nc(N(C)CCCc2nccn2C)c2c(C)nn(C)c2n1.
What is the InChIKey of N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is HRFVOMABWGDRSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N7/c1-11-14-15(18-12(2)19-16(14)23(5)20-11)22(4)9-6-7-13-17-8-10-21(13)3/h8,10H,6-7,9H2,1-5H3.
What are the key properties of N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine?
N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 313.41 g/mol, XLogP of 1.78, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3,6-tetramethyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 70751078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).