4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine

C19H29N7 — CID 72897517

IUPAC4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine
SMILESCCc1cc(N2CCC(NCc3cnc(C)cn3)CC2)nc(N(C)C)n1
InChIInChI=1S/C19H29N7/c1-5-15-10-18(24-19(23-15)25(3)4)26-8-6-16(7-9-26)22-13-17-12-20-14(2)11-21-17/h10-12,16,22H,5-9,13H2,1-4H3
InChIKeyDRWXLFYJZHXGGJ-UHFFFAOYSA-N
MW355.49 g/mol
LogP1.96
Rot. Bonds6

About 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine

4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine (PubChem CID 72897517) has the molecular formula C19H29N7 and a molecular weight of 355.49 g/mol. Its IUPAC name is 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine
PubChem CID72897517
Molecular FormulaC19H29N7
Molecular Weight355.49 g/mol
Exact Mass355.25
IUPAC Name4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine
SMILESCCc1cc(N2CCC(NCc3cnc(C)cn3)CC2)nc(N(C)C)n1
InChIInChI=1S/C19H29N7/c1-5-15-10-18(24-19(23-15)25(3)4)26-8-6-16(7-9-26)22-13-17-12-20-14(2)11-21-17/h10-12,16,22H,5-9,13H2,1-4H3
InChIKeyDRWXLFYJZHXGGJ-UHFFFAOYSA-N
XLogP1.96
TPSA70.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.49
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine with MolForge

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Related Compounds

(5R)-5-[[[1-[2-(dimethylamino)-6-ethylpyrimidin-4-yl]piperidin-4-yl]amino]methyl]pyrrolidin-2-one
CID 97276197
4-ethyl-N,N-dimethyl-6-[4-[[(1S)-1-pyridin-4-ylpropyl]amino]piperidin-1-yl]pyrimidin-2-amine
CID 97285280
N,N-dimethyl-4-[(5-methylpyrazin-2-yl)methylamino]piperidine-1-carboxamide
CID 83261720
N-[(5-methylpyrazin-2-yl)methyl]-1-phenylpiperidin-4-amine
CID 103778023
ethyl 4-[(5-methylpyrazin-2-yl)methylamino]piperidine-1-carboxylate
CID 62847535
2-(dimethylamino)-4-[(3R,4R)-4-(dimethylsulfamoylamino)-3-hydroxypiperidin-1-yl]-6-ethylpyrimidine
CID 118768707
4-tert-butyl-N-[(5-methylpyrazin-2-yl)methyl]cyclohexan-1-amine
CID 62845689
N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
CID 107379247
1-methyl-3-[4-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]phenyl]imidazolidin-2-one
CID 31016726
1-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)-N-(pyridin-3-ylmethyl)piperidin-4-amine
CID 72893953
N-[(1-ethylpyrazol-4-yl)methyl]-1-(6-ethylpyrimidin-4-yl)piperidin-4-amine
CID 71980330
1,5-dimethyl-N-[(5-methylpyrazin-2-yl)methyl]pyrrolidin-3-amine
CID 81466069

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine?
The IUPAC name of 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine (CID 72897517) is 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine?
The canonical SMILES for 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine is CCc1cc(N2CCC(NCc3cnc(C)cn3)CC2)nc(N(C)C)n1.
What is the InChIKey of 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine?
The InChIKey is DRWXLFYJZHXGGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N7/c1-5-15-10-18(24-19(23-15)25(3)4)26-8-6-16(7-9-26)22-13-17-12-20-14(2)11-21-17/h10-12,16,22H,5-9,13H2,1-4H3.
What are the key properties of 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine?
4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine has a molecular weight of 355.49 g/mol, XLogP of 1.96, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N,N-dimethyl-6-[4-[(5-methylpyrazin-2-yl)methylamino]piperidin-1-yl]pyrimidin-2-amine is sourced from PubChem (CID 72897517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).