[1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol

C15H19N5O — CID 71933069

IUPAC[1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1c1cc(NCc2ccccn2)ncn1
InChIInChI=1S/C15H19N5O/c21-10-13-5-3-7-20(13)15-8-14(18-11-19-15)17-9-12-4-1-2-6-16-12/h1-2,4,6,8,11,13,21H,3,5,7,9-10H2,(H,17,18,19)
InChIKeyDDEIUICHVIGKCQ-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.44
Rot. Bonds5

About [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol

[1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol (PubChem CID 71933069) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
PubChem CID71933069
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name[1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1c1cc(NCc2ccccn2)ncn1
InChIInChI=1S/C15H19N5O/c21-10-13-5-3-7-20(13)15-8-14(18-11-19-15)17-9-12-4-1-2-6-16-12/h1-2,4,6,8,11,13,21H,3,5,7,9-10H2,(H,17,18,19)
InChIKeyDDEIUICHVIGKCQ-UHFFFAOYSA-N
XLogP1.44
TPSA74.17 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol 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 [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol?
The IUPAC name of [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol (CID 71933069) is [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol is OCC1CCCN1c1cc(NCc2ccccn2)ncn1.
What is the InChIKey of [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol?
The InChIKey is DDEIUICHVIGKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c21-10-13-5-3-7-20(13)15-8-14(18-11-19-15)17-9-12-4-1-2-6-16-12/h1-2,4,6,8,11,13,21H,3,5,7,9-10H2,(H,17,18,19).
What are the key properties of [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol?
[1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol has a molecular weight of 285.35 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 71933069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).