2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine

C17H30N6O — CID 72876686

IUPAC2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine
SMILESCC(C1CCN(c2cc(N)nc(N(C)C)n2)CC1)N1CCOCC1
InChIInChI=1S/C17H30N6O/c1-13(22-8-10-24-11-9-22)14-4-6-23(7-5-14)16-12-15(18)19-17(20-16)21(2)3/h12-14H,4-11H2,1-3H3,(H2,18,19,20)
InChIKeyGBHRNKIYSIZIPM-UHFFFAOYSA-N
MW334.47 g/mol
LogP1.06
Rot. Bonds4

About 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine

2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine (PubChem CID 72876686) has the molecular formula C17H30N6O and a molecular weight of 334.47 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine
PubChem CID72876686
Molecular FormulaC17H30N6O
Molecular Weight334.47 g/mol
Exact Mass334.25
IUPAC Name2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine
SMILESCC(C1CCN(c2cc(N)nc(N(C)C)n2)CC1)N1CCOCC1
InChIInChI=1S/C17H30N6O/c1-13(22-8-10-24-11-9-22)14-4-6-23(7-5-14)16-12-15(18)19-17(20-16)21(2)3/h12-14H,4-11H2,1-3H3,(H2,18,19,20)
InChIKeyGBHRNKIYSIZIPM-UHFFFAOYSA-N
XLogP1.06
TPSA70.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.47
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine with MolForge

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Related Compounds

4-[(1R)-1-[1-(6-ethylpyrimidin-4-yl)piperidin-4-yl]ethyl]morpholine
CID 97199716
N,N,5-trimethyl-2-[4-[(1S)-1-morpholin-4-ylethyl]piperidin-1-yl]pyrimidin-4-amine
CID 97203243
2-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]quinoline-4-carboxylic acid
CID 97200460
4-[1-[1-(6-fluoro-4-methylquinolin-2-yl)piperidin-4-yl]ethyl]morpholine
CID 72871994
6-[(3R,4S)-3-amino-4-cyclopropylpyrrolidin-1-yl]-2-N,2-N-dimethylpyrimidine-2,4-diamine
CID 72934333
2-[1-[2-(dimethylamino)-6-propan-2-ylpyrimidin-4-yl]piperidin-4-yl]propan-1-ol
CID 154842261
[2-(dimethylamino)-4-methylpyrimidin-5-yl]-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]methanone
CID 70732353
2-cyclopropyl-6-(4-propan-2-ylazepan-1-yl)pyrimidin-4-amine
CID 80959750
1-[2-(dimethylamino)-6-propan-2-ylpyrimidin-4-yl]piperidine-4-carboxamide
CID 154838840
(3R,4R)-1-[6-amino-2-(dimethylamino)pyrimidin-4-yl]-4-cyclopropylpyrrolidine-3-carboxylic acid
CID 133115900
6-[4-(dimethylamino)piperidin-1-yl]pyrimidine-2,4-diamine
CID 80792622
N,N-dimethyl-5-[[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]methyl]-1,3-thiazol-2-amine
CID 95893735

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine?
The IUPAC name of 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine (CID 72876686) is 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine?
The canonical SMILES for 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine is CC(C1CCN(c2cc(N)nc(N(C)C)n2)CC1)N1CCOCC1.
What is the InChIKey of 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine?
The InChIKey is GBHRNKIYSIZIPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N6O/c1-13(22-8-10-24-11-9-22)14-4-6-23(7-5-14)16-12-15(18)19-17(20-16)21(2)3/h12-14H,4-11H2,1-3H3,(H2,18,19,20).
What are the key properties of 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine?
2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine has a molecular weight of 334.47 g/mol, XLogP of 1.06, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-6-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]pyrimidine-2,4-diamine is sourced from PubChem (CID 72876686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).