N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine

C18H18N4 — CID 135368333

IUPACN-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine
SMILESc1cc(-c2cc(NC3CCCC3)c3ccncc3n2)ccn1
InChIInChI=1S/C18H18N4/c1-2-4-14(3-1)21-17-11-16(13-5-8-19-9-6-13)22-18-12-20-10-7-15(17)18/h5-12,14H,1-4H2,(H,21,22)
InChIKeyVSMXTOSKEAQWJW-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.05
Rot. Bonds3

About N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine

N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine (PubChem CID 135368333) has the molecular formula C18H18N4 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine.

Molecular Properties

Compound NameN-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine
PubChem CID135368333
Molecular FormulaC18H18N4
Molecular Weight290.37 g/mol
Exact Mass290.15
IUPAC NameN-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine
SMILESc1cc(-c2cc(NC3CCCC3)c3ccncc3n2)ccn1
InChIInChI=1S/C18H18N4/c1-2-4-14(3-1)21-17-11-16(13-5-8-19-9-6-13)22-18-12-20-10-7-15(17)18/h5-12,14H,1-4H2,(H,21,22)
InChIKeyVSMXTOSKEAQWJW-UHFFFAOYSA-N
XLogP4.05
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine?
The IUPAC name of N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine (CID 135368333) is N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine.
What is the SMILES notation for N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine?
The canonical SMILES for N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine is c1cc(-c2cc(NC3CCCC3)c3ccncc3n2)ccn1.
What is the InChIKey of N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine?
The InChIKey is VSMXTOSKEAQWJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4/c1-2-4-14(3-1)21-17-11-16(13-5-8-19-9-6-13)22-18-12-20-10-7-15(17)18/h5-12,14H,1-4H2,(H,21,22).
What are the key properties of N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine?
N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine has a molecular weight of 290.37 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-pyridin-4-yl-1,7-naphthyridin-4-amine is sourced from PubChem (CID 135368333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).