1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine

C15H20N6 — CID 77235789

IUPAC1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(c2ccnc(C(N)c3ccccn3)n2)C1
InChIInChI=1S/C15H20N6/c1-17-11-6-9-21(10-11)13-5-8-19-15(20-13)14(16)12-4-2-3-7-18-12/h2-5,7-8,11,14,17H,6,9-10,16H2,1H3
InChIKeyDGETWDKIAFQMCV-UHFFFAOYSA-N
MW284.37 g/mol
LogP0.72
Rot. Bonds4

About 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine

1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine (PubChem CID 77235789) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine
PubChem CID77235789
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC Name1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(c2ccnc(C(N)c3ccccn3)n2)C1
InChIInChI=1S/C15H20N6/c1-17-11-6-9-21(10-11)13-5-8-19-15(20-13)14(16)12-4-2-3-7-18-12/h2-5,7-8,11,14,17H,6,9-10,16H2,1H3
InChIKeyDGETWDKIAFQMCV-UHFFFAOYSA-N
XLogP0.72
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine with MolForge

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

Launch Full Analysis

Related Compounds

(3R)-N-methyl-1-(2-propan-2-ylpyrimidin-4-yl)pyrrolidin-3-amine
CID 118720438
(3R)-N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 141191344
N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 79002061
N-cyclopentyl-4-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 58227252
2-methyl-1-[[4-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-yl]amino]propan-2-ol
CID 58227103
1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine
CID 106820380
(3R)-N-methyl-1-pyridazin-3-ylpyrrolidin-3-amine
CID 177337485
CID 87167788
CID 87167788
N-(2-bicyclo[2.2.1]heptanyl)-4-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 58227148
ethane;1-methyl-3-(1-pyridin-2-ylpyrrolidin-3-yl)urea
CID 91102074
4-[(3S)-3-(methylamino)pyrrolidin-1-yl]-6-propan-2-ylpyrimidin-2-amine
CID 53377888
N-methyl-1-(5-methyl-2-pyridinyl)pyrrolidin-3-amine
CID 59535689

Frequently Asked Questions

What is the IUPAC name of 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine?
The IUPAC name of 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine (CID 77235789) is 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine.
What is the SMILES notation for 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine?
The canonical SMILES for 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine is CNC1CCN(c2ccnc(C(N)c3ccccn3)n2)C1.
What is the InChIKey of 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine?
The InChIKey is DGETWDKIAFQMCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6/c1-17-11-6-9-21(10-11)13-5-8-19-15(20-13)14(16)12-4-2-3-7-18-12/h2-5,7-8,11,14,17H,6,9-10,16H2,1H3.
What are the key properties of 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine?
1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine has a molecular weight of 284.37 g/mol, XLogP of 0.72, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[amino(pyridin-2-yl)methyl]pyrimidin-4-yl]-N-methylpyrrolidin-3-amine is sourced from PubChem (CID 77235789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).