N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine

C13H18N2 — CID 59176540

IUPACN-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine
SMILESCCN(C(C)C)C1C=Cc2cccnc21
InChIInChI=1S/C13H18N2/c1-4-15(10(2)3)12-8-7-11-6-5-9-14-13(11)12/h5-10,12H,4H2,1-3H3
InChIKeyGZSDWNINRXIBQV-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.88
Rot. Bonds3

About N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine

N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine (PubChem CID 59176540) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine.

Molecular Properties

Compound NameN-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine
PubChem CID59176540
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC NameN-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine
SMILESCCN(C(C)C)C1C=Cc2cccnc21
InChIInChI=1S/C13H18N2/c1-4-15(10(2)3)12-8-7-11-6-5-9-14-13(11)12/h5-10,12H,4H2,1-3H3
InChIKeyGZSDWNINRXIBQV-UHFFFAOYSA-N
XLogP2.88
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine?
The IUPAC name of N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine (CID 59176540) is N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine.
What is the SMILES notation for N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine?
The canonical SMILES for N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine is CCN(C(C)C)C1C=Cc2cccnc21.
What is the InChIKey of N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine?
The InChIKey is GZSDWNINRXIBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-4-15(10(2)3)12-8-7-11-6-5-9-14-13(11)12/h5-10,12H,4H2,1-3H3.
What are the key properties of N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine?
N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine has a molecular weight of 202.30 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propan-2-yl-7H-cyclopenta[b]pyridin-7-amine is sourced from PubChem (CID 59176540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).