4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine

C14H20N6O — CID 103341824

IUPAC4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine
SMILESCCCNc1nc(-c2ccc[nH]2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H20N6O/c1-2-5-16-13-17-12(11-4-3-6-15-11)18-14(19-13)20-7-9-21-10-8-20/h3-4,6,15H,2,5,7-10H2,1H3,(H,16,17,18,19)
InChIKeyBGLOUAFQQVLKNH-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.53
Rot. Bonds5

About 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine

4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine (PubChem CID 103341824) has the molecular formula C14H20N6O and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine
PubChem CID103341824
Molecular FormulaC14H20N6O
Molecular Weight288.35 g/mol
Exact Mass288.17
IUPAC Name4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine
SMILESCCCNc1nc(-c2ccc[nH]2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H20N6O/c1-2-5-16-13-17-12(11-4-3-6-15-11)18-14(19-13)20-7-9-21-10-8-20/h3-4,6,15H,2,5,7-10H2,1H3,(H,16,17,18,19)
InChIKeyBGLOUAFQQVLKNH-UHFFFAOYSA-N
XLogP1.53
TPSA78.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine
CID 103341850
4-methoxy-6-morpholin-4-yl-N-propyl-1,3,5-triazin-2-amine
CID 80766525
4-N-methyl-6-morpholin-4-yl-2-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine
CID 80772544
1-[[4-morpholin-4-yl-6-(propylamino)-1,3,5-triazin-2-yl]amino]propan-2-ol
CID 80773597
4-N,4-N-dimethyl-6-(1,4-oxazepan-4-yl)-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80822984
2-N-hexyl-6-morpholin-4-yl-4-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
CID 2172668
N-butyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80931737
2-N-ethyl-6-morpholin-4-yl-4-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
CID 645138
4-(1H-indol-4-yl)-6-morpholin-4-yl-N-(2-pyridin-3-ylethyl)-1,3,5-triazin-2-amine
CID 58508140
6-methyl-4-N-(2-morpholin-4-ylphenyl)-2-N-propylpyrimidine-2,4-diamine
CID 112907068
N'-[4-(2-methylbenzimidazol-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]ethane-1,2-diamine
CID 159415308
4-(3-iminocyclohepta-1,4,6-trien-1-yl)-6-morpholin-4-yl-N-(2-pyridin-4-ylethyl)-1,3,5-triazin-2-amine
CID 91032419

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine (CID 103341824) is 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine is CCCNc1nc(-c2ccc[nH]2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine?
The InChIKey is BGLOUAFQQVLKNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-2-5-16-13-17-12(11-4-3-6-15-11)18-14(19-13)20-7-9-21-10-8-20/h3-4,6,15H,2,5,7-10H2,1H3,(H,16,17,18,19).
What are the key properties of 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine?
4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine has a molecular weight of 288.35 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-N-propyl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 103341824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).