N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine

C19H25N5 — CID 86806537

IUPACN-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine
SMILESCCN(C)C1CCN(c2nc(-c3ccccn3)nc3c2CCC3)C1
InChIInChI=1S/C19H25N5/c1-3-23(2)14-10-12-24(13-14)19-15-7-6-9-16(15)21-18(22-19)17-8-4-5-11-20-17/h4-5,8,11,14H,3,6-7,9-10,12-13H2,1-2H3
InChIKeyLZVMWTKFVHXZEL-UHFFFAOYSA-N
MW323.44 g/mol
LogP2.56
Rot. Bonds4

About N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine

N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine (PubChem CID 86806537) has the molecular formula C19H25N5 and a molecular weight of 323.44 g/mol. Its IUPAC name is N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine
PubChem CID86806537
Molecular FormulaC19H25N5
Molecular Weight323.44 g/mol
Exact Mass323.21
IUPAC NameN-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine
SMILESCCN(C)C1CCN(c2nc(-c3ccccn3)nc3c2CCC3)C1
InChIInChI=1S/C19H25N5/c1-3-23(2)14-10-12-24(13-14)19-15-7-6-9-16(15)21-18(22-19)17-8-4-5-11-20-17/h4-5,8,11,14H,3,6-7,9-10,12-13H2,1-2H3
InChIKeyLZVMWTKFVHXZEL-UHFFFAOYSA-N
XLogP2.56
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine?
The IUPAC name of N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine (CID 86806537) is N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine.
What is the SMILES notation for N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine?
The canonical SMILES for N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine is CCN(C)C1CCN(c2nc(-c3ccccn3)nc3c2CCC3)C1.
What is the InChIKey of N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine?
The InChIKey is LZVMWTKFVHXZEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5/c1-3-23(2)14-10-12-24(13-14)19-15-7-6-9-16(15)21-18(22-19)17-8-4-5-11-20-17/h4-5,8,11,14H,3,6-7,9-10,12-13H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine?
N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine has a molecular weight of 323.44 g/mol, XLogP of 2.56, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-amine is sourced from PubChem (CID 86806537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).