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

C19H23N5 — CID 157371099

IUPACN-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESC=C1CCC(Nc2nc(-c3ccccn3)nc3c2CCC3)CN1C
InChIInChI=1S/C19H23N5/c1-13-9-10-14(12-24(13)2)21-18-15-6-5-8-16(15)22-19(23-18)17-7-3-4-11-20-17/h3-4,7,11,14H,1,5-6,8-10,12H2,2H3,(H,21,22,23)
InChIKeyHOYIWUKCNLUFFP-UHFFFAOYSA-N
MW321.43 g/mol
LogP3.05
Rot. Bonds3

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

N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 157371099) has the molecular formula C19H23N5 and a molecular weight of 321.43 g/mol. Its IUPAC name is N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID157371099
Molecular FormulaC19H23N5
Molecular Weight321.43 g/mol
Exact Mass321.20
IUPAC NameN-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESC=C1CCC(Nc2nc(-c3ccccn3)nc3c2CCC3)CN1C
InChIInChI=1S/C19H23N5/c1-13-9-10-14(12-24(13)2)21-18-15-6-5-8-16(15)22-19(23-18)17-7-3-4-11-20-17/h3-4,7,11,14H,1,5-6,8-10,12H2,2H3,(H,21,22,23)
InChIKeyHOYIWUKCNLUFFP-UHFFFAOYSA-N
XLogP3.05
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 157371099) is N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is C=C1CCC(Nc2nc(-c3ccccn3)nc3c2CCC3)CN1C.
What is the InChIKey of N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is HOYIWUKCNLUFFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5/c1-13-9-10-14(12-24(13)2)21-18-15-6-5-8-16(15)22-19(23-18)17-7-3-4-11-20-17/h3-4,7,11,14H,1,5-6,8-10,12H2,2H3,(H,21,22,23).
What are the key properties of N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 321.43 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-methylidenepiperidin-3-yl)-2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 157371099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).