N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine

C21H26N6 — CID 66959667

IUPACN-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine
SMILESCN1C=Nc2cc(-c3ccc(N4CCCCC4)nc3)nc(NC3CC3)c2C1
InChIInChI=1S/C21H26N6/c1-26-13-17-19(23-14-26)11-18(25-21(17)24-16-6-7-16)15-5-8-20(22-12-15)27-9-3-2-4-10-27/h5,8,11-12,14,16H,2-4,6-7,9-10,13H2,1H3,(H,24,25)
InChIKeyKWOROEABHUDKCW-UHFFFAOYSA-N
MW362.48 g/mol
LogP3.81
Rot. Bonds4

About N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine

N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine (PubChem CID 66959667) has the molecular formula C21H26N6 and a molecular weight of 362.48 g/mol. Its IUPAC name is N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine.

Molecular Properties

Compound NameN-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine
PubChem CID66959667
Molecular FormulaC21H26N6
Molecular Weight362.48 g/mol
Exact Mass362.22
IUPAC NameN-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine
SMILESCN1C=Nc2cc(-c3ccc(N4CCCCC4)nc3)nc(NC3CC3)c2C1
InChIInChI=1S/C21H26N6/c1-26-13-17-19(23-14-26)11-18(25-21(17)24-16-6-7-16)15-5-8-20(22-12-15)27-9-3-2-4-10-27/h5,8,11-12,14,16H,2-4,6-7,9-10,13H2,1H3,(H,24,25)
InChIKeyKWOROEABHUDKCW-UHFFFAOYSA-N
XLogP3.81
TPSA56.65 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-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-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine?
The IUPAC name of N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine (CID 66959667) is N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine.
What is the SMILES notation for N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine?
The canonical SMILES for N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine is CN1C=Nc2cc(-c3ccc(N4CCCCC4)nc3)nc(NC3CC3)c2C1.
What is the InChIKey of N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine?
The InChIKey is KWOROEABHUDKCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N6/c1-26-13-17-19(23-14-26)11-18(25-21(17)24-16-6-7-16)15-5-8-20(22-12-15)27-9-3-2-4-10-27/h5,8,11-12,14,16H,2-4,6-7,9-10,13H2,1H3,(H,24,25).
What are the key properties of N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine?
N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine has a molecular weight of 362.48 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-methyl-7-(6-piperidin-1-yl-3-pyridinyl)-4H-pyrido[4,3-d]pyrimidin-5-amine is sourced from PubChem (CID 66959667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).