5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine

C14H23N5O — CID 123875025

IUPAC5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine
SMILESc1nc(NC2CCNC2)ncc1OCC1CCNCC1
InChIInChI=1S/C14H23N5O/c1-4-15-5-2-11(1)10-20-13-8-17-14(18-9-13)19-12-3-6-16-7-12/h8-9,11-12,15-16H,1-7,10H2,(H,17,18,19)
InChIKeyAYKKINYNNFUHKI-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.63
Rot. Bonds5

About 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine

5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine (PubChem CID 123875025) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine.

Molecular Properties

Compound Name5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine
PubChem CID123875025
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine
SMILESc1nc(NC2CCNC2)ncc1OCC1CCNCC1
InChIInChI=1S/C14H23N5O/c1-4-15-5-2-11(1)10-20-13-8-17-14(18-9-13)19-12-3-6-16-7-12/h8-9,11-12,15-16H,1-7,10H2,(H,17,18,19)
InChIKeyAYKKINYNNFUHKI-UHFFFAOYSA-N
XLogP0.63
TPSA71.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-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

Related Compounds

5-bromo-N-pyrrolidin-3-ylpyrimidin-2-amine
CID 63872650
5-tert-butyl-N-pyrrolidin-3-ylpyrimidin-2-amine
CID 116974701
N-(5-methoxypyrimidin-2-yl)azepan-3-amine
CID 114600932
N-[(3R)-pyrrolidin-3-yl]-5-(trifluoromethyl)pyrimidin-2-amine
CID 125498682
2-cyclopentyl-5-(pyrrolidin-3-ylmethoxy)pyrimidine
CID 117230949
4-[(1-methylpyrazol-4-yl)oxymethyl]piperidine
CID 114608454
5-(difluoromethoxy)-N-piperidin-4-ylpyrimidin-2-amine;ethane
CID 177057062
2-bromo-5-(piperidin-4-ylmethoxy)pyridine;hydrochloride
CID 118109642
N-(azetidin-3-yl)-5-methoxypyrimidin-2-amine
CID 114600963
5-(3-fluorophenyl)-N-pyrrolidin-3-ylpyrimidin-2-amine
CID 116974721
5-cyclohexyl-N-piperidin-3-ylpyrimidin-2-amine
CID 116974757
2-phenyl-5-(piperidin-4-ylmethoxy)pyridine
CID 127025530

Frequently Asked Questions

What is the IUPAC name of 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine?
The IUPAC name of 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine (CID 123875025) is 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine.
What is the SMILES notation for 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine?
The canonical SMILES for 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine is c1nc(NC2CCNC2)ncc1OCC1CCNCC1.
What is the InChIKey of 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine?
The InChIKey is AYKKINYNNFUHKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-4-15-5-2-11(1)10-20-13-8-17-14(18-9-13)19-12-3-6-16-7-12/h8-9,11-12,15-16H,1-7,10H2,(H,17,18,19).
What are the key properties of 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine?
5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine has a molecular weight of 277.37 g/mol, XLogP of 0.63, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(piperidin-4-ylmethoxy)-N-pyrrolidin-3-ylpyrimidin-2-amine is sourced from PubChem (CID 123875025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).