N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine

C19H26N6O2 — CID 24747173

IUPACN-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
SMILESCCOc1ccccc1Nc1nc(N2CCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C19H26N6O2/c1-2-27-16-8-4-3-7-15(16)20-17-21-18(24-9-5-6-10-24)23-19(22-17)25-11-13-26-14-12-25/h3-4,7-8H,2,5-6,9-14H2,1H3,(H,20,21,22,23)
InChIKeyZBGMUWGIMBCBOY-UHFFFAOYSA-N
MW370.46 g/mol
LogP2.45
Rot. Bonds6

About N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine

N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine (PubChem CID 24747173) has the molecular formula C19H26N6O2 and a molecular weight of 370.46 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
PubChem CID24747173
Molecular FormulaC19H26N6O2
Molecular Weight370.46 g/mol
Exact Mass370.21
IUPAC NameN-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
SMILESCCOc1ccccc1Nc1nc(N2CCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C19H26N6O2/c1-2-27-16-8-4-3-7-15(16)20-17-21-18(24-9-5-6-10-24)23-19(22-17)25-11-13-26-14-12-25/h3-4,7-8H,2,5-6,9-14H2,1H3,(H,20,21,22,23)
InChIKeyZBGMUWGIMBCBOY-UHFFFAOYSA-N
XLogP2.45
TPSA75.64 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-[4-(5-Chloro-2-methoxy-phenylamino)-6-pyrrolidin-1-yl-[1,3,5]triazin-2-ylamino]-ethanol
CID 650378
2-[[4-[[2-(1,1-Dimethylethoxy)phenyl]amino]-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
CID 17757274
N-(2-methoxyphenyl)-6-(piperidin-1-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 942531
6-chloro-N,N'-bis(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine
CID 3634041
2-[[4-(2-Methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
CID 23648021
2-[[4-(4-Methoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
CID 23648023
2-({4-[(2-Ethoxyphenyl)amino]-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl}amino)ethan-1-ol
CID 23648025
2-[[4-(2-Phenoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
CID 23648026
2-[[4-(5-Chloro-2-ethoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
CID 23648036
N-tert-butyl-6-chloro-N'-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine
CID 744431
N-(2-ethoxyphenyl)-6-[(2-methylpiperidin-1-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 2950845
N-(4-Methoxy-phenyl)-6-morpholin-4-ylmethyl-[1,3,5]triazine-2,4-diamine
CID 651619

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine (CID 24747173) is N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine is CCOc1ccccc1Nc1nc(N2CCCC2)nc(N2CCOCC2)n1.
What is the InChIKey of N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is ZBGMUWGIMBCBOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O2/c1-2-27-16-8-4-3-7-15(16)20-17-21-18(24-9-5-6-10-24)23-19(22-17)25-11-13-26-14-12-25/h3-4,7-8H,2,5-6,9-14H2,1H3,(H,20,21,22,23).
What are the key properties of N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 370.46 g/mol, XLogP of 2.45, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-4-morpholin-4-yl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 24747173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).