N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C19H29N7 — CID 56720767

IUPACN-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCNc1nc(N2CCN(Cc3nccn3C(C)C)CC2)nc2c1CCC2
InChIInChI=1S/C19H29N7/c1-14(2)26-8-7-21-17(26)13-24-9-11-25(12-10-24)19-22-16-6-4-5-15(16)18(20-3)23-19/h7-8,14H,4-6,9-13H2,1-3H3,(H,20,22,23)
InChIKeyLKZJPQPICBMAFD-UHFFFAOYSA-N
MW355.49 g/mol
LogP2.11
Rot. Bonds5

About N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 56720767) has the molecular formula C19H29N7 and a molecular weight of 355.49 g/mol. Its IUPAC name is N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID56720767
Molecular FormulaC19H29N7
Molecular Weight355.49 g/mol
Exact Mass355.25
IUPAC NameN-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCNc1nc(N2CCN(Cc3nccn3C(C)C)CC2)nc2c1CCC2
InChIInChI=1S/C19H29N7/c1-14(2)26-8-7-21-17(26)13-24-9-11-25(12-10-24)19-22-16-6-4-5-15(16)18(20-3)23-19/h7-8,14H,4-6,9-13H2,1-3H3,(H,20,22,23)
InChIKeyLKZJPQPICBMAFD-UHFFFAOYSA-N
XLogP2.11
TPSA62.11 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.49
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 56720767) is N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is CNc1nc(N2CCN(Cc3nccn3C(C)C)CC2)nc2c1CCC2.
What is the InChIKey of N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is LKZJPQPICBMAFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N7/c1-14(2)26-8-7-21-17(26)13-24-9-11-25(12-10-24)19-22-16-6-4-5-15(16)18(20-3)23-19/h7-8,14H,4-6,9-13H2,1-3H3,(H,20,22,23).
What are the key properties of N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 355.49 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-[(1-propan-2-ylimidazol-2-yl)methyl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 56720767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).