N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine

C14H17N7 — CID 178106057

IUPACN-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCCN(Cc1cccnc1N)c1nc(C)nc2[nH]ncc12
InChIInChI=1S/C14H17N7/c1-3-21(8-10-5-4-6-16-12(10)15)14-11-7-17-20-13(11)18-9(2)19-14/h4-7H,3,8H2,1-2H3,(H2,15,16)(H,17,18,19,20)
InChIKeyFUBONPAVAQPNEC-UHFFFAOYSA-N
MW283.34 g/mol
LogP1.67
Rot. Bonds4

About N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine

N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 178106057) has the molecular formula C14H17N7 and a molecular weight of 283.34 g/mol. Its IUPAC name is N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID178106057
Molecular FormulaC14H17N7
Molecular Weight283.34 g/mol
Exact Mass283.15
IUPAC NameN-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCCN(Cc1cccnc1N)c1nc(C)nc2[nH]ncc12
InChIInChI=1S/C14H17N7/c1-3-21(8-10-5-4-6-16-12(10)15)14-11-7-17-20-13(11)18-9(2)19-14/h4-7H,3,8H2,1-2H3,(H2,15,16)(H,17,18,19,20)
InChIKeyFUBONPAVAQPNEC-UHFFFAOYSA-N
XLogP1.67
TPSA96.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine (CID 178106057) is N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine is CCN(Cc1cccnc1N)c1nc(C)nc2[nH]ncc12.
What is the InChIKey of N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is FUBONPAVAQPNEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N7/c1-3-21(8-10-5-4-6-16-12(10)15)14-11-7-17-20-13(11)18-9(2)19-14/h4-7H,3,8H2,1-2H3,(H2,15,16)(H,17,18,19,20).
What are the key properties of N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 283.34 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-amino-3-pyridinyl)methyl]-N-ethyl-6-methyl-1H-pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 178106057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).