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

C19H33N5O — CID 97271688

IUPAC4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine
SMILESCCc1cc(N2CCC(NC[C@@]3(C)CCCO3)CC2)nc(N(C)C)n1
InChIInChI=1S/C19H33N5O/c1-5-15-13-17(22-18(21-15)23(3)4)24-10-7-16(8-11-24)20-14-19(2)9-6-12-25-19/h13,16,20H,5-12,14H2,1-4H3/t19-/m1/s1
InChIKeyONTMNHLEWANJLE-LJQANCHMSA-N
MW347.51 g/mol
LogP2.23
Rot. Bonds6

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

4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine (PubChem CID 97271688) has the molecular formula C19H33N5O and a molecular weight of 347.51 g/mol. Its IUPAC name is 4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine
PubChem CID97271688
Molecular FormulaC19H33N5O
Molecular Weight347.51 g/mol
Exact Mass347.27
IUPAC Name4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine
SMILESCCc1cc(N2CCC(NC[C@@]3(C)CCCO3)CC2)nc(N(C)C)n1
InChIInChI=1S/C19H33N5O/c1-5-15-13-17(22-18(21-15)23(3)4)24-10-7-16(8-11-24)20-14-19(2)9-6-12-25-19/h13,16,20H,5-12,14H2,1-4H3/t19-/m1/s1
InChIKeyONTMNHLEWANJLE-LJQANCHMSA-N
XLogP2.23
TPSA53.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.51
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine?
The IUPAC name of 4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine (CID 97271688) is 4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine?
The canonical SMILES for 4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine is CCc1cc(N2CCC(NC[C@@]3(C)CCCO3)CC2)nc(N(C)C)n1.
What is the InChIKey of 4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine?
The InChIKey is ONTMNHLEWANJLE-LJQANCHMSA-N. The full InChI is InChI=1S/C19H33N5O/c1-5-15-13-17(22-18(21-15)23(3)4)24-10-7-16(8-11-24)20-14-19(2)9-6-12-25-19/h13,16,20H,5-12,14H2,1-4H3/t19-/m1/s1.
What are the key properties of 4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine?
4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine has a molecular weight of 347.51 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine is sourced from PubChem (CID 97271688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).