4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine

C15H22N6 — CID 71525589

IUPAC4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine
SMILESCN[C@@H]1CCN(c2nc(N)nc3cc(C(C)C)cnc23)C1
InChIInChI=1S/C15H22N6/c1-9(2)10-6-12-13(18-7-10)14(20-15(16)19-12)21-5-4-11(8-21)17-3/h6-7,9,11,17H,4-5,8H2,1-3H3,(H2,16,19,20)/t11-/m1/s1
InChIKeyVZBVZINFDHFRML-LLVKDONJSA-N
MW286.38 g/mol
LogP1.53
Rot. Bonds3

About 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine

4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine (PubChem CID 71525589) has the molecular formula C15H22N6 and a molecular weight of 286.38 g/mol. Its IUPAC name is 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine
PubChem CID71525589
Molecular FormulaC15H22N6
Molecular Weight286.38 g/mol
Exact Mass286.19
IUPAC Name4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine
SMILESCN[C@@H]1CCN(c2nc(N)nc3cc(C(C)C)cnc23)C1
InChIInChI=1S/C15H22N6/c1-9(2)10-6-12-13(18-7-10)14(20-15(16)19-12)21-5-4-11(8-21)17-3/h6-7,9,11,17H,4-5,8H2,1-3H3,(H2,16,19,20)/t11-/m1/s1
InChIKeyVZBVZINFDHFRML-LLVKDONJSA-N
XLogP1.53
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-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 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine?
The IUPAC name of 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine (CID 71525589) is 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine.
What is the SMILES notation for 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine?
The canonical SMILES for 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine is CN[C@@H]1CCN(c2nc(N)nc3cc(C(C)C)cnc23)C1.
What is the InChIKey of 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine?
The InChIKey is VZBVZINFDHFRML-LLVKDONJSA-N. The full InChI is InChI=1S/C15H22N6/c1-9(2)10-6-12-13(18-7-10)14(20-15(16)19-12)21-5-4-11(8-21)17-3/h6-7,9,11,17H,4-5,8H2,1-3H3,(H2,16,19,20)/t11-/m1/s1.
What are the key properties of 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine?
4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine has a molecular weight of 286.38 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-7-propan-2-ylpyrido[3,2-d]pyrimidin-2-amine is sourced from PubChem (CID 71525589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).