2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine

C16H28N6O2 — CID 112887262

IUPAC2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
SMILESc1cc(NCCN2CCOCC2)nc(NCCN2CCOCC2)n1
InChIInChI=1S/C16H28N6O2/c1-2-18-16(19-4-6-22-9-13-24-14-10-22)20-15(1)17-3-5-21-7-11-23-12-8-21/h1-2H,3-14H2,(H2,17,18,19,20)
InChIKeyLFTQDRVDZDTCAZ-UHFFFAOYSA-N
MW336.44 g/mol
LogP-0.04
Rot. Bonds8

About 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine

2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine (PubChem CID 112887262) has the molecular formula C16H28N6O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
PubChem CID112887262
Molecular FormulaC16H28N6O2
Molecular Weight336.44 g/mol
Exact Mass336.23
IUPAC Name2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
SMILESc1cc(NCCN2CCOCC2)nc(NCCN2CCOCC2)n1
InChIInChI=1S/C16H28N6O2/c1-2-18-16(19-4-6-22-9-13-24-14-10-22)20-15(1)17-3-5-21-7-11-23-12-8-21/h1-2H,3-14H2,(H2,17,18,19,20)
InChIKeyLFTQDRVDZDTCAZ-UHFFFAOYSA-N
XLogP-0.04
TPSA74.78 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine 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

4-N-(2-morpholin-4-ylethyl)-2-N-prop-2-enylpyrimidine-2,4-diamine
CID 112882667
4-N-cyclopropyl-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112882231
2-N-(2,6-difluorophenyl)-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887432
2-N-(3,4-dimethylphenyl)-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887341
4-N-[2,6-di(propan-2-yl)phenyl]-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887559
4-N-[(3-methylphenyl)methyl]-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887443
2-N-[2-(1H-indol-3-yl)ethyl]-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887299
4-N-[2-(1H-indol-3-yl)ethyl]-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887471
4-N-[2-(3-methoxyphenyl)ethyl]-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887463
4-methoxy-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 112683355
4-N-(4-ethoxyphenyl)-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887526
4-N-(2-tert-butylphenyl)-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887514

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine?
The IUPAC name of 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine (CID 112887262) is 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine?
The canonical SMILES for 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine is c1cc(NCCN2CCOCC2)nc(NCCN2CCOCC2)n1.
What is the InChIKey of 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine?
The InChIKey is LFTQDRVDZDTCAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N6O2/c1-2-18-16(19-4-6-22-9-13-24-14-10-22)20-15(1)17-3-5-21-7-11-23-12-8-21/h1-2H,3-14H2,(H2,17,18,19,20).
What are the key properties of 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine?
2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine has a molecular weight of 336.44 g/mol, XLogP of -0.04, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 112887262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).