N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine

C17H19N7O — CID 133487716

IUPACN,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine
SMILESCN(C)c1noc(CNc2nc(-c3ccncc3)nc3c2CCC3)n1
InChIInChI=1S/C17H19N7O/c1-24(2)17-21-14(25-23-17)10-19-16-12-4-3-5-13(12)20-15(22-16)11-6-8-18-9-7-11/h6-9H,3-5,10H2,1-2H3,(H,19,20,22)
InChIKeyNUHBZXAJQDQMMV-UHFFFAOYSA-N
MW337.39 g/mol
LogP2.09
Rot. Bonds5

About N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine

N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine (PubChem CID 133487716) has the molecular formula C17H19N7O and a molecular weight of 337.39 g/mol. Its IUPAC name is N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine
PubChem CID133487716
Molecular FormulaC17H19N7O
Molecular Weight337.39 g/mol
Exact Mass337.17
IUPAC NameN,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine
SMILESCN(C)c1noc(CNc2nc(-c3ccncc3)nc3c2CCC3)n1
InChIInChI=1S/C17H19N7O/c1-24(2)17-21-14(25-23-17)10-19-16-12-4-3-5-13(12)20-15(22-16)11-6-8-18-9-7-11/h6-9H,3-5,10H2,1-2H3,(H,19,20,22)
InChIKeyNUHBZXAJQDQMMV-UHFFFAOYSA-N
XLogP2.09
TPSA92.86 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.39
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-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

N',N'-dimethyl-N-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)ethane-1,2-diamine
CID 53192920
N,N'-bis(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)propane-1,3-diamine
CID 166186696
N-[[(2R)-oxolan-2-yl]methyl]-2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 95111490
N-methyl-N-[4-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]phenyl]pyridine-4-carboxamide
CID 133316321
N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 133347418
N-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-2-pyridin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 166222228
N-[[2-(dimethylamino)phenyl]methyl]-2-pyridin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 166219815
1-cyclopentyl-2-[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]ethanol
CID 133306823
N-[2-(3,6-dihydro-2H-pyran-4-yl)ethyl]-2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 133390262
N-[(4-methyl-1,2-oxazol-3-yl)methyl]-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 136559621
2-phenyl-N-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62191758
2-chloro-N-(pyridin-4-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 82460692

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine?
The IUPAC name of N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine (CID 133487716) is N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine.
What is the SMILES notation for N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine?
The canonical SMILES for N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine is CN(C)c1noc(CNc2nc(-c3ccncc3)nc3c2CCC3)n1.
What is the InChIKey of N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine?
The InChIKey is NUHBZXAJQDQMMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N7O/c1-24(2)17-21-14(25-23-17)10-19-16-12-4-3-5-13(12)20-15(22-16)11-6-8-18-9-7-11/h6-9H,3-5,10H2,1-2H3,(H,19,20,22).
What are the key properties of N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine?
N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine has a molecular weight of 337.39 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[[(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]methyl]-1,2,4-oxadiazol-3-amine is sourced from PubChem (CID 133487716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).