N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine

C13H18N4 — CID 20689537

IUPACN-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine
SMILESCc1nc2c(c(C)c1NC1=NCCN1)CCC2
InChIInChI=1S/C13H18N4/c1-8-10-4-3-5-11(10)16-9(2)12(8)17-13-14-6-7-15-13/h3-7H2,1-2H3,(H2,14,15,17)
InChIKeyPTQOMBIYKXRQNQ-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.56
Rot. Bonds1

About N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine

N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine (PubChem CID 20689537) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine.

Molecular Properties

Compound NameN-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine
PubChem CID20689537
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC NameN-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine
SMILESCc1nc2c(c(C)c1NC1=NCCN1)CCC2
InChIInChI=1S/C13H18N4/c1-8-10-4-3-5-11(10)16-9(2)12(8)17-13-14-6-7-15-13/h3-7H2,1-2H3,(H2,14,15,17)
InChIKeyPTQOMBIYKXRQNQ-UHFFFAOYSA-N
XLogP1.56
TPSA49.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine?
The IUPAC name of N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine (CID 20689537) is N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine.
What is the SMILES notation for N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine?
The canonical SMILES for N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine is Cc1nc2c(c(C)c1NC1=NCCN1)CCC2.
What is the InChIKey of N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine?
The InChIKey is PTQOMBIYKXRQNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-8-10-4-3-5-11(10)16-9(2)12(8)17-13-14-6-7-15-13/h3-7H2,1-2H3,(H2,14,15,17).
What are the key properties of N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine?
N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine has a molecular weight of 230.31 g/mol, XLogP of 1.56, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dihydro-1H-imidazol-2-yl)-2,4-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine is sourced from PubChem (CID 20689537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).