N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine

C15H26N4O — CID 80941958

IUPACN,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine
SMILESCCNc1cc(OCCC2CCCN2C)nc(CC)n1
InChIInChI=1S/C15H26N4O/c1-4-13-17-14(16-5-2)11-15(18-13)20-10-8-12-7-6-9-19(12)3/h11-12H,4-10H2,1-3H3,(H,16,17,18)
InChIKeyMATRIUBDSPBEMM-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.33
Rot. Bonds7

About N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine

N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine (PubChem CID 80941958) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine.

Molecular Properties

Compound NameN,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine
PubChem CID80941958
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine
SMILESCCNc1cc(OCCC2CCCN2C)nc(CC)n1
InChIInChI=1S/C15H26N4O/c1-4-13-17-14(16-5-2)11-15(18-13)20-10-8-12-7-6-9-19(12)3/h11-12H,4-10H2,1-3H3,(H,16,17,18)
InChIKeyMATRIUBDSPBEMM-UHFFFAOYSA-N
XLogP2.33
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethyl-N-methyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine
CID 80942065
2-cyclopropyl-N-ethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine
CID 80965957
N-ethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyridin-2-amine
CID 80870418
N-ethyl-4-methyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine
CID 80871209
6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-N-propylpyrimidin-4-amine
CID 80870896
N,2-diethyl-6-[2-(3-methoxypropoxy)ethoxy]pyrimidin-4-amine
CID 103176424
2-ethyl-6-hydrazinyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-4-amine
CID 106026109
6-[3-(dimethylamino)propoxy]-N,2-diethylpyrimidin-4-amine
CID 80941359
2-chloro-4-methyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidine
CID 62477621
N-ethyl-5-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyridin-3-amine
CID 113424373
N-ethyl-5-methyl-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine
CID 80870503
N-ethyl-5-fluoro-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-2-amine
CID 80870420

Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine?
The IUPAC name of N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine (CID 80941958) is N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine.
What is the SMILES notation for N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine?
The canonical SMILES for N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine is CCNc1cc(OCCC2CCCN2C)nc(CC)n1.
What is the InChIKey of N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine?
The InChIKey is MATRIUBDSPBEMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-13-17-14(16-5-2)11-15(18-13)20-10-8-12-7-6-9-19(12)3/h11-12H,4-10H2,1-3H3,(H,16,17,18).
What are the key properties of N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine?
N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine has a molecular weight of 278.40 g/mol, XLogP of 2.33, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrimidin-4-amine is sourced from PubChem (CID 80941958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).